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Home/Compounds/CAS 1033805-28-5
Formula C25H22ClF3N6O3MW 546.9Research-use catalog entryCOA/SDS by request

Telotristat

CAS Number: 1033805-28-5

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Loading RDKit molecule structure...
InChIKey: NCLGDOBQAWBXRA-PGRDOPGGSA-NC25H22ClF3N6O3 | MW 546.9

Chemical Absolute Identifiers

CAS Number

1033805-28-5

PubChem CID

25025298

Molecular Formula

C25H22ClF3N6O3

Molecular Weight

546.9 g/mol

Exact Mass

546.139401

InChIKey

NCLGDOBQAWBXRA-PGRDOPGGSA-N

IUPAC Name

(2S)-2-amino-3-[4-[2-amino-6-[(1R)-1-[4-chloro-2-(3-methylpyrazol-1-yl)phenyl]-2,2,2-trifluoroethoxy]pyrimidin-4-yl]phenyl]propanoic acid

SMILES String

Cc1ccn(-c2cc(Cl)ccc2[C@@H](Oc2cc(-c3ccc(C[C@H](N)C(=O)O)cc3)nc(N)n2)C(F)(F)F)n1

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

Telotristat (CAS 1033805-28-5) is listed in the Advanced Chemicals portfolio, with molecular formula C25H22ClF3N6O3 and molecular weight 546. 90 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

Asymmetric SynthesisSynthetic 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: Tryptophan 5-hydroxylase 1 (Homo sapiens) — 4 assays; Tryptophan 5-hydroxylase 2 (Homo sapiens) — 2 assays; Prostaglandin G/H synthase 1 (Homo sapiens) — 2 assays; Sodium-dependent noradrenaline transporter (Homo sapiens) — 2 assays; Estrogen receptor (Homo sapiens) — 3 assays. These records describe research assays and do not establish therapeutic efficacy or clinical use.

Tryptophan 5-hydroxylase 1

Homo sapiens · SINGLE PROTEIN · 4 qualifying assays · 4 documents · best pChEMBL 7.8

Experimental evidence source: ChEMBL

Tryptophan 5-hydroxylase 2

Homo sapiens · SINGLE PROTEIN · 2 qualifying assays · 2 documents · best pChEMBL 6.15

Experimental evidence source: ChEMBL

Prostaglandin G/H synthase 1

Homo sapiens · SINGLE PROTEIN · 2 qualifying assays · 1 documents · best pChEMBL 5.79

Experimental evidence source: ChEMBL

Sodium-dependent noradrenaline transporter

Homo sapiens · SINGLE PROTEIN · 2 qualifying assays · 1 documents · best pChEMBL 5.03

Experimental evidence source: ChEMBL

Estrogen receptor

Homo sapiens · SINGLE PROTEIN · 3 qualifying assays · 1 documents · best pChEMBL 4.77

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

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

Safety Reference / SDS Request

Names & Synonyms / External Identifiers

Chemical Name

Telotristat

Names & Synonyms

LP 778902(2S)-2-amino-3-(4-{2-amino-6-[(1R)-1-[4-chloro-2-(3-methyl-1H-pyrazol-1-yl)phenyl]-2,2,2-trifluoroethoxy]pyrimidin-4-yl}phenyl)propanoic acidtelotristatum(2S)-2-amino-3-(4-(2-amino-6-((1R)-1-(4-chloro-2-(3-methyl-1H-pyrazol-1-yl)phenyl)-2,2,2-trifluoroethoxy)pyrimidin-4-yl)phenyl)propanoic acid(S)-2-amino-3-(4-(2-amino-6-((R)-1-(4-chloro-2-(3-methyl-1H-pyrazol-1-yl)phenyl)-2,2,2-trifluoroethoxy)pyrimidin-4-yl)phenyl)propanoic acid
Show all synonyms
(2S)-2-aMino-3-[4-[2-aMino-6-[(1R)-1-[4-chloro-2-(3-Methylpyrazol-1-yl)phenyl]-2,2,2-trifluoroethoxy]pyriMidin-4-yl]phenyl]propanoic acid, Telotristat4-[2-Amino-6-[(1R)-1-[4-chloro-2-(3-methyl-1H-pyrazol-1-yl)phenyl]-2,2,2-trifluoroethoxy]-4-pyrimidinyl]-L-phenylalanineTelotristat [USAN]Telotristat [USAN:INN]Telotristat (Standard)TELOTRISTAT [MI]TELOTRISTAT [INN]Telotristat (USAN/INN)Telotristat, LP778902A1IT9TELOTRISTAT [WHO-DD]C25H22ClF3N6O3(2S)-2-amino-3-[4-[2-amino-6-[(1R)-1-[4-chloro-2-(3-methylpyrazol-1-yl)phenyl]-2,2,2-trifluoro-ethoxy]pyrimidin-4-yl]phenyl]propanoic acid(2S)-2-amino-3-[4-[2-amino-6-[(1R)-1-[4-chloro-2-(3-methylpyrazol-1-yl)phenyl]-2,2,2-triluoroethoxy]pyrimidin-4-yl]phenyl]propanoic acid
External Identifiers
DSSTOX SUBSTANCE ID: DTXSID60145805CHEMBL ID: CHEMBL2103855CHEBI ID: CHEBI:177736UNII: 381V4FCV2ZDRUGBANK ID: DB14218KEGG ID: D09973METABOLOMICS WORKBENCH ID: 154877NCI THESAURUS CODE: C152549RXCUI: 1872382WIKIDATA ID: Q27256725
Literature & Patent References
DOI 10.1021/acs.jmedchem.3c01454Structure-Based Design of Xanthine-Imidazopyridines and -Imidazothiazoles as Highly Potent and In Vivo Efficacious Tryptophan Hydroxylase Inhibitors.DOI 10.1038/s41467-023-40064-9A preclinical secondary pharmacology resource illuminates target-adverse drug reaction associations of marketed drugs.PMID 37468498A preclinical secondary pharmacology resource illuminates target-adverse drug reaction associations of marketed drugs.PMID 37905925Structure-Based Design of Xanthine-Imidazopyridines and -Imidazothiazoles as Highly Potent and In Vivo Efficacious Tryptophan Hydroxylase Inhibitors.DOI 10.1021/acs.jmedchem.2c00598Structure-Based Design of Xanthine-Benzimidazole Derivatives as Novel and Potent Tryptophan Hydroxylase Inhibitors.PMID 35921615Structure-Based Design of Xanthine-Benzimidazole Derivatives as Novel and Potent Tryptophan Hydroxylase Inhibitors.DOI 10.6019/CHEMBL4651402Screening of ~5500 FDA-approved drugs and clinical candidates for anti-SARS-CoV-2 activityDOI 10.1101/2020.04.21.054387Identification of potential treatments for COVID-19 through artificial intelligence-enabled phenomic analysis of human cells infected with SARS-CoV-2

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.
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Text Reference Cues

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Non-public related references

D-PhenylalanineCAS 673-06-3

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 114-07-8ErythromycinCAS 1393477-72-9SelinexorCAS 181695-72-7ValdecoxibCAS 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 acidCAS 1018144-00-72-(3-Cyclopropyl-6-isopropyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridin-1-yl)acetic acid

RFQ questions for CAS 1033805-28-5

What are the key identifiers for Telotristat (CAS 1033805-28-5)?

Telotristat is identified by CAS 1033805-28-5, with molecular formula C25H22ClF3N6O3, molecular weight 546.9, InChIKey NCLGDOBQAWBXRA-PGRDOPGGSA-N.

Does CAS 1033805-28-5 have reported biological target evidence?

ChEMBL contains qualifying experimental assay evidence associated with Tryptophan 5-hydroxylase 1, Tryptophan 5-hydroxylase 2, Prostaglandin G/H synthase 1, Sodium-dependent noradrenaline transporter, Estrogen receptor. These records do not establish therapeutic efficacy or clinical use.

Can I request a COA for CAS 1033805-28-5?

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

Can I request supplier SDS for Telotristat?

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Is CAS 1033805-28-5 available for quotation?

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