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Home/Compounds/CAS 4311-88-0
Formula C13H13N3OSMW 259.33Research-use catalog entryCOA/SDS by request

4-(1H-indol-3-ylmethyl)-1-methyl-2-sulfanyl-4H-imidazol-5-one

CAS Number: 4311-88-0

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Loading RDKit molecule structure...
InChIKey: TXUWMXQFNYDOEZ-UHFFFAOYSA-NC13H13N3OS | MW 259.33

Chemical Absolute Identifiers

CAS Number

4311-88-0

PubChem CID

643951

Molecular Formula

C13H13N3OS

Molecular Weight

259.33 g/mol

Exact Mass

259.077933

InChIKey

TXUWMXQFNYDOEZ-UHFFFAOYSA-N

SMILES String

CN1C(=O)C(N=C1S)CC2=CNC3=CC=CC=C32

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

4-(1H-indol-3-ylmethyl)-1-methyl-2-sulfanyl-4H-imidazol-5-one (CAS 4311-88-0) is listed in the Advanced Chemicals portfolio, with molecular formula C13H13N3OS and molecular weight 259. 33 g/mol.

Sourcing context

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

Research use context

Intended for research building-block and synthetic chemistry 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

Heterocyclic Building BlocksSynthetic ChemistryResearch intermediateCustom synthesis building blockResearch chemical sourcingCustom synthesis and catalog availability reviewCOA, SDS, pricing, and fulfillment workflow
Biological target reference

ChEMBL reports experimental activity evidence for: Receptor-interacting serine/threonine-protein kinase 1 (Homo sapiens) — 10 assays; Indoleamine 2,3-dioxygenase 1 (Homo sapiens) — 11 assays; Nuclear receptor ROR-gamma (Mus musculus) — 2 assays; Cytochrome P450 3A4 (Homo sapiens) — 2 assays; Cellular tumor antigen p53 (Homo sapiens) — 2 assays. These records describe research assays and do not establish therapeutic efficacy or clinical use.

Receptor-interacting serine/threonine-protein kinase 1

Homo sapiens · SINGLE PROTEIN · 10 qualifying assays · 8 documents · best pChEMBL 7.02

Experimental evidence source: ChEMBL

Indoleamine 2,3-dioxygenase 1

Homo sapiens · SINGLE PROTEIN · 11 qualifying assays · 9 documents · best pChEMBL 6.96

Experimental evidence source: ChEMBL

Nuclear receptor ROR-gamma

Mus musculus · SINGLE PROTEIN · 2 qualifying assays · 1 documents · best pChEMBL 5.55

Experimental evidence source: ChEMBL

Cytochrome P450 3A4

Homo sapiens · SINGLE PROTEIN · 2 qualifying assays · 1 documents · best pChEMBL 5.2

Experimental evidence source: ChEMBL

Cellular tumor antigen p53

Homo sapiens · SINGLE PROTEIN · 2 qualifying assays · 1 documents · best pChEMBL 4.9

Experimental evidence source: ChEMBL

Safety & Handling

Safety and handling reference content is available through documentation requests.

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

Preliminary Safety Reference

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Names & Synonyms / External Identifiers

Chemical Name

4-(1H-indol-3-ylmethyl)-1-methyl-2-sulfanyl-4H-imidazol-5-one

Literature & Patent References
DOI 10.1016/j.ejmech.2025.117530Discovery of phenylisoxazolidine analogs targeting receptor interacting protein kinase 1 with anti-inflammatory activity.PMID 40153932Discovery of phenylisoxazolidine analogs targeting receptor interacting protein kinase 1 with anti-inflammatory activity.DOI 10.1016/j.ejmech.2024.116123RIPK1 inhibitors: A key to unlocking the potential of necroptosis in drug development.DOI 10.1021/acs.jmedchem.4c00949Discovery of Covalent MLKL PROTAC Degraders via Optimization of a Theophylline Derivative Ligand for Treating Necroptosis.DOI 10.1021/acs.jmedchem.4c01731Polypharmacological Drug Design Guided by Integrating Phenotypic and Restricted Fragment Docking Strategies.PMID 38199165RIPK1 inhibitors: A key to unlocking the potential of necroptosis in drug development.PMID 39180479Discovery of Covalent MLKL PROTAC Degraders via Optimization of a Theophylline Derivative Ligand for Treating Necroptosis.PMID 39300597Polypharmacological Drug Design Guided by Integrating Phenotypic and Restricted Fragment Docking Strategies.

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

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Non-public related references

4-(2-methylsulfanylethyl)-1-phenyl-2-sulfanyl-4H-imidazol-5-oneCAS 4370-90-5
3-(5-oxo-1-phenyl-2-sulfanyl-4H-imidazol-4-yl)propanoic acidCAS 5624-27-1
4-methyl-1-phenyl-2-sulfanyl-4H-imidazol-5-oneCAS 4333-19-1
1-phenyl-4-propan-2-yl-2-sulfanyl-4H-imidazol-5-oneCAS 4333-20-4
5-Benzyl-2-tert-butyl-3-methyl-4-imidazolidinone, (2S,5S)-CAS 346440-54-8

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 50-65-7NiclosamideCAS 520-36-5ApigeninCAS 60628-96-8BifonazoleCAS 60940-34-3EbselenCAS 877399-52-5CrizotinibCAS 1002310-00-0Tert-butyl 1-(2-chloro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)ethylcarbamateCAS 1005174-17-3(E)-3-(2-Propyl-6-(trifluoromethyl)pyridin-3-yl)acrylic acidCAS 1018125-49-92-(3-Cyclopropyl-6-ethyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridin-1-yl)acetic acidCAS 1018128-07-8Isopropyl 4-chloro-2-methylquinoline-6-carboxylateCAS 1018142-22-76-cyclopropyl-1-(2,2-difluoroethyl)-3-methyl-1H-pyrazolo[3,4-b]pyridine-4-carboxylic acid

RFQ questions for CAS 4311-88-0

What are the key identifiers for 4-(1H-indol-3-ylmethyl)-1-methyl-2-sulfanyl-4H-imidazol-5-one (CAS 4311-88-0)?

4-(1H-indol-3-ylmethyl)-1-methyl-2-sulfanyl-4H-imidazol-5-one is identified by CAS 4311-88-0, with molecular formula C13H13N3OS, molecular weight 259.33, InChIKey TXUWMXQFNYDOEZ-UHFFFAOYSA-N.

Does CAS 4311-88-0 have reported biological target evidence?

ChEMBL contains qualifying experimental assay evidence associated with Receptor-interacting serine/threonine-protein kinase 1, Indoleamine 2,3-dioxygenase 1, Nuclear receptor ROR-gamma, Cytochrome P450 3A4, Cellular tumor antigen p53. These records do not establish therapeutic efficacy or clinical use.

Can I request a COA for CAS 4311-88-0?

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

Can I request supplier SDS for 4-(1H-indol-3-ylmethyl)-1-methyl-2-sulfanyl-4H-imidazol-5-one?

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Is CAS 4311-88-0 available for quotation?

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