MolGraph
CompoundsDocumentationComplianceAbout
MolGraph

Research chemical sourcing and molecular building block RFQ workflows.

MolGraph is operated by Tessorix Inc.

support@molgraph.com

Products are intended for laboratory research use only and are not for human or veterinary use.

Compounds

  • Compound catalog
  • CAS Search

Company

  • About
  • Contact

Documentation

  • Quality Documentation
  • SDS Disclaimer

Compliance

  • Compliance

Legal

  • Terms
  • Privacy

Copyright © 2026 MolGraph. All Rights Reserved.

Home/Compounds/CAS 84625-61-6
Formula C35H38Cl2N8O4MW 705.6Research-use catalog entryCOA/SDS by request

Itrizole

CAS Number: 84625-61-6

Sourcing & RFQ

Submit an RFQ to review pricing, availability, lead time, pack size, purity, COA, and supplier SDS for this catalog entry.

Supply options

Availability by request

Availability
Available by request
Documents
COA/SDS available on request
Shipping
Shipping reviewed before dispatch

Public pricing is not shown for this CAS. Submit an RFQ to confirm availability, documentation, and shipping review.

Loading RDKit molecule structure...
InChIKey: VHVPQPYKVGDNFY-UHFFFAOYSA-NC35H38Cl2N8O4 | MW 705.6

Chemical Absolute Identifiers

CAS Number

84625-61-6

PubChem CID

3793

Molecular Formula

C35H38Cl2N8O4

Molecular Weight

705.6 g/mol

Exact Mass

704.239307

InChIKey

VHVPQPYKVGDNFY-UHFFFAOYSA-N

IUPAC Name

2-butan-2-yl-4-[4-[4-[4-[[2-(2,4-dichlorophenyl)-2-(1,2,4-triazol-1-ylmethyl)-1,3-dioxolan-4-yl]methoxy]phenyl]piperazin-1-yl]phenyl]-1,2,4-triazol-3-one

SMILES String

CCC(C)N1C(=O)N(C=N1)C2=CC=C(C=C2)N3CCN(CC3)C4=CC=C(C=C4)OCC5COC(O5)(CN6C=NC=N6)C7=C(C=C(C=C7)Cl)Cl

Physical Properties

No physical property values available.

Properties are provided as catalog reference data and may be confirmed through supplier documentation when required.

Catalog Facts

Structural features

Itrizole (CAS 84625-61-6) is listed in the Pharmaceutical Intermediates portfolio, with molecular formula C35H38Cl2N8O4 and molecular weight 705. 60 g/mol.

Sourcing context

Catalog reference for RFQ preparation, supplier confirmation, and research chemical sourcing review.

Research use context

Intended for research-stage medicinal chemistry and intermediate synthesis workflows; structure-derived tags include nitrogen-containing heterocycle.

Documentation needs

COA/SDS status, availability, lead time, pack size, and shipment documentation can be confirmed during quotation.

Applications & Classification

Pharmaceutical Intermediate ResearchResearch intermediateCustom synthesis building blockPharmaceutical intermediate researchResearch chemical sourcingCustom synthesis and catalog availability reviewCOA, SDS, pricing, and fulfillment workflow
Biological target reference

ChEMBL reports experimental activity evidence for: ATP-dependent translocase ABCB1 (Homo sapiens) — 11 assays; Cytochrome P450 3A4 (Homo sapiens) — 10 assays; C-X-C chemokine receptor type 1 (Homo sapiens) — 3 assays; C-C chemokine receptor type 4 (Homo sapiens) — 4 assays; ATP-dependent translocase ABCB1 (Mus musculus) — 2 assays. These records describe research assays and do not establish therapeutic efficacy or clinical use.

ATP-dependent translocase ABCB1

Homo sapiens · SINGLE PROTEIN · 11 qualifying assays · 4 documents · best pChEMBL 7.52

Experimental evidence source: ChEMBL

Cytochrome P450 3A4

Homo sapiens · SINGLE PROTEIN · 10 qualifying assays · 10 documents · best pChEMBL 7.49

Experimental evidence source: ChEMBL

C-X-C chemokine receptor type 1

Homo sapiens · SINGLE PROTEIN · 3 qualifying assays · 1 documents · best pChEMBL 7

Experimental evidence source: ChEMBL

C-C chemokine receptor type 4

Homo sapiens · SINGLE PROTEIN · 4 qualifying assays · 1 documents · best pChEMBL 6.7

Experimental evidence source: ChEMBL

ATP-dependent translocase ABCB1

Mus musculus · SINGLE PROTEIN · 2 qualifying assays · 1 documents · best pChEMBL 6.7

Experimental evidence source: ChEMBL

Safety & Handling

Handling & Storage

  • Keep container tightly closed and dry.
  • Store in a well-ventilated place.

PPE

Respiratory protection if needed

First Aid

  • Do not give anything to an unconscious person.
  • Rinse mouth with water.

Stability / Reactivity

  • Reactivity.
  • Carbon monoxide, carbon dioxide, hydrogen chloride, nitrogen oxides.

Disposal

  • Waste product.
  • Dispose of remaining and non-recyclable solutions to a licensed company.
Show additional safety reference fields

Fire Fighting

  • If necessary, wear a self-contained breathing apparatus during firefighting.

Accidental Release

  • Do not generate dust when collecting and disposing.
  • Sweep and shovel up.

For supplier-issued SDS, request documentation before handling, storage, shipment, or procurement decisions.

Preliminary Safety Reference

For supplier-issued SDS or COA, submit a documentation request.

Safety Reference / SDS Request

Names & Synonyms / External Identifiers

Chemical Name

Itrizole

Names & Synonyms

2-butan-2-yl-4-(4-(4-(4-((2-(2,4-dichlorophenyl)-2-(1,2,4-triazol-1-ylmethyl)-1,3-dioxolan-4-yl)methoxy)phenyl)piperazin-1-yl)phenyl)-1,2,4-triazol-3-one1-(Butan-2-yl)-4-{4-[4-(4-{[2-(2,4-dichlorophenyl)-2-[(1H-1,2,4-triazol-1-yl)methyl]-1,3-dioxolan-4-yl]methoxy}phenyl)piperazin-1-yl]phenyl}-4,5-dihydro-1H-1,2,4-triazol-5-oneItraconazolum [Latin]C35H38Cl2N8O44-(4-(4-(4-((2-((1H-1,2,4-triazol-1-yl)methyl)-2-(2,4-dichlorophenyl)-1,3-dioxolan-4-yl)methoxy)phenyl)piperazin-1-yl)phenyl)-1-(sec-butyl)-1H-1,2,4-triazol-5(4H)-one
Show all synonyms
Itraconazole D32-butan-2-yl-4-[4-[4-[4-[[2-(2,4-dichlorophenyl)-2-(1,2,4-triazol-1-ylmethyl)-1,3-dioxolan-4-yl]methoxy]phenyl]-1-piperazinyl]phenyl]-1,2,4-triazol-3-one4-(4-(4-(4-((2-((1H-1,2,4-Triazol-1-yl)methyl)-2-(2,4-dichlorophenyl)-1,3-dioxolan-4-yl)methoxy)phenyl)piperazin-1-yl)phenyl)-2-(sec-butyl)-2,4-dihydro-3H-1,2,4-triazol-3-oneItraconzaoleITRAZOLEItraconazole (racemate)Opera_ID_902Itraconazole, >=98% (TLC)Itraconazole - Bio-X trade markI07324-[4-[4-[4-[[2-(2,4-dichlorophenyl)-2-(1,2,4-triazol-1-ylmethyl)-1,3-dioxolan-4-yl]methoxy]phenyl]piperazin-1-yl]phenyl]-2-sec-butyl-1,2,4-triazol-3-one
External Identifiers
EC NUMBER: 283-347-2EC NUMBER: 831-526-6CHEBI ID: CHEBI:94366HMDB ID: HMDB0253309WIKIDATA ID: Q27166205
Literature & Patent References
DOI 10.1021/acs.jmedchem.4c01465TKK130 is a 3-Hydroxy-Propanamidine (HPA) with Potent Antimalarial <i>In Vivo</i> Activity and a High Barrier to Resistance.PMID 39723908TKK130 is a 3-Hydroxy-Propanamidine (HPA) with Potent Antimalarial <i>In Vivo</i> Activity and a High Barrier to Resistance.DOI 10.1016/j.bmc.2023.117543Design, synthesis, evaluation and optimization of novel azole analogues as potent antifungal agents.DOI 10.1016/j.ejmech.2024.116720Emerging therapeutics: The imidazo[1,2-b]pyridazine scaffold as a novel drug candidate for eumycetoma, a neglected tropical disease.DOI 10.1016/j.ejmech.2024.116870Tetrazoles: A multi-potent motif in drug design.DOI 10.1016/j.isci.2024.108907Identification and evaluation of small-molecule inhibitors against the dNTPase SAMHD1 via a comprehensive screening funnelDOI 10.1021/acs.jmedchem.3c02426Selenization of Small Molecule Drugs: A New Player on the Board.DOI 10.1021/acs.jmedchem.4c00652Triazoles in Medicinal Chemistry: Physicochemical Properties, Bioisosterism, and Application.

Documentation & Compliance Facts

Compliance Facts

Shipment review: Required

Documentation available by request

Certificate of Analysis (COA): By request

Supplier Safety Data Sheet (SDS): By request

Purity and pack size confirmation: By request

Availability and lead time review: Confirmed by RFQ

Shipment documentation review: By request

For supplier-issued documentation by request, use the RFQ actions on this page.Review preliminary safety reference

What happens after RFQ

  1. 1We review the CAS identity, quantity, and documentation request.
  2. 2We check sourcing options, supplier availability, COA/SDS, purity, pack size, and lead time.
  3. 3We review destination and shipment documentation needs when applicable.
  4. 4We follow up with a quotation or clarification request.

Text Reference Cues

Show non-linked catalog cues

Non-public related references

4-(4-(4-(4-((2-(2,4-Dichlorophenyl)-2-((1H-1,2,4-triazol-1-yl)methyl)-1,3-dioxolan-4-yl)methoxy)phenyl)piperazin-1-yl)phenyl)-2-(3-hydroxybutan-2-yl)-2,4-dihydro-3H-1,2,4-triazol-3-oneCAS 112559-91-8
SaperconazoleCAS 110588-57-3
1-(4-((2-(2,4-Dichlorophenyl)-2-((1H-1,2,4-triazol-1-yl)methyl)-1,3-dioxolan-4-yl)methoxy)phenyl)-4-(propan-2-yl)piperazineCAS 67915-31-5
1-(4-(4-((2-(2,4-Dichlorophenyl)-2-(1H-imidazol-1-ylmethyl)-1,3-dioxolan-4-yl)methoxy)phenyl)piperazin-1-yl)ethanoneCAS 65277-42-1
(2R,4S)-KetoconazoleCAS 142128-59-4

Non-public references are shown as text only and do not imply equivalence, availability, or shared use.

Catalog navigation

Related Catalog Entries

Other public CAS pages in this catalog. These links support navigation across additional intermediates and do not imply equivalence, availability, or shared use.

CAS 112559-91-84-(4-(4-(4-((2-(2,4-Dichlorophenyl)-2-((1H-1,2,4-triazol-1-yl)methyl)-1,3-dioxolan-4-yl)methoxy)phenyl)piperazin-1-yl)phenyl)-2-(3-hydroxybutan-2-yl)-2,4-dihydro-3H-1,2,4-triazol-3-oneCAS 110588-57-3SaperconazoleCAS 67915-31-51-(4-((2-(2,4-Dichlorophenyl)-2-((1H-1,2,4-triazol-1-yl)methyl)-1,3-dioxolan-4-yl)methoxy)phenyl)-4-(propan-2-yl)piperazineCAS 65277-42-11-(4-(4-((2-(2,4-Dichlorophenyl)-2-(1H-imidazol-1-ylmethyl)-1,3-dioxolan-4-yl)methoxy)phenyl)piperazin-1-yl)ethanoneCAS 142128-59-4(2R,4S)-KetoconazoleCAS 23593-75-1ClotrimazoleCAS 21829-25-4NifedipineCAS 55142-85-3TiclopidineCAS 22916-47-8MiconazoleCAS 1002310-00-0Tert-butyl 1-(2-chloro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)ethylcarbamate

RFQ questions for CAS 84625-61-6

What are the key identifiers for Itrizole (CAS 84625-61-6)?

Itrizole is identified by CAS 84625-61-6, with molecular formula C35H38Cl2N8O4, molecular weight 705.6, InChIKey VHVPQPYKVGDNFY-UHFFFAOYSA-N.

Does CAS 84625-61-6 have reported biological target evidence?

ChEMBL contains qualifying experimental assay evidence associated with ATP-dependent translocase ABCB1, Cytochrome P450 3A4, C-X-C chemokine receptor type 1, C-C chemokine receptor type 4, ATP-dependent translocase ABCB1. These records do not establish therapeutic efficacy or clinical use.

Can I request a COA for CAS 84625-61-6?

Yes. Submit an RFQ and specify COA requirements. Lot-specific COA depends on supplier confirmation.

Can I request supplier SDS for Itrizole?

Yes. Supplier SDS can be requested through the RFQ workflow before handling, storage, shipment, or procurement decisions.

Is CAS 84625-61-6 available for quotation?

Availability, pack size, lead time, and pricing are confirmed through RFQ.

Can MolGraph support bulk sourcing or custom synthesis review?

Submit the CAS number, quantity, purity requirement, and destination country for sourcing review.