CAS 203640-27-1 S-3304 (HCID 10718956)

기본 정보

CAS: 203640-27-1
표준 SMILES: Cc1ccc(C#Cc2ccc(S(=O)(=O)N[C@H](Cc3c[nH]c4ccccc34)C(=O)O)s2)cc1
InChIKey: YWCLDDLVLSQGSZ-JOCHJYFZSA-N
분자식: C24H20N2O4S2
평균 분자량: 464.6 g/mol
단동위원소 질량: 464.08644947

이름 및 식별자

우선 이름: S-3304
IUPAC: (2R)-3-(1H-indol-3-yl)-2-[[5-[2-(4-methylphenyl)ethynyl]thiophen-2-yl]sulfonylamino]propanoic acid
영어명: (R)-3-(1H-Indol-3-yl)-2-(5-(p-tolylethynyl)thiophene-2-sulfonamido)propanoic acid
분자식: C24H20N2O4S2
분자량: 464.56

이름 및 동의어

203640-27-1S 3304S-3304D-Tryptophan, N-[[5-[2-(4-methylphenyl)ethynyl]-2-thienyl]sulfonyl]-DTXSID20174292D-Tryptophan, N-((5-(2-(4-methylphenyl)ethynyl)-2-thienyl)sulfonyl)-BK459F050Xs3304D-Tryptophan, N-((5-((4-methylphenyl)ethynyl)-2-thienyl)sulfonyl)-S3304 cpdRefChem:180607MMP Inhibitor S-3304

이름 더 보기

S 3304, 10 mM in DMSOR-3-(1H-Indol-3-yl)-2-(5-(p-tolyleth ynyl)thiophene-2S 3304,Inhibitor,inhibit,S3304,MMP,S-3304,Matrix metalloproteinases(R)-3-(1H-Indol-3-yl)-2-(5-p-tolylethynyl-thiophene-2-sulfonylamino)-propionic acid(2R)-3-(1H-indol-3-yl)-2-{5-[2-(4-methylphenyl)ethynyl]thiophene-2-sulfonamido}propanoic acid(2R)-3-(1H-indol-3-yl)-2-[[5-[2-(4-methylphenyl)ethynyl]thiophen-2-yl]sulfonylamino]propanoic acid

DTXCID9096783(2R)-3-(1H-indol-3-yl)-2-(5-(2-(4-methylphenyl)ethynyl)thiophene-2-sulfonamido)propanoic acid((5-(p-tolylethynyl)thiophen-2-yl)sulfonyl)-D-tryptophan(R)-3-(1H-Indol-3-yl)-2-(5-(p-tolylethynyl)thiophene-2-sulfonamido)propanoic acidCHEMBL297792SCHEMBL2380826BDBM50063129AKOS030593350

데이터베이스 식별자

CAS: 203640-27-1
PubChem CID: 10718956
DTXSID: DTXSID20174292
ChEMBL: CHEMBL297792
UNII: BK459F050X
Nikkaji: J1.119.150I

물성

구조 계산 물성

XLogP: 5
극성 표면적: 136 Å²
수소 결합 공여자 수: 3
수소 결합 수용자 수: 6
회전 가능 결합 수: 8
무거운 원자 수: 32
형식 전하: 0
복잡도: 835

물리화학적 성질

끓는 점: 745.7 · 745.7±70.0 °C(Predicted)
밀도: 1.47 · 1.47±0.1 g/cm3(Predicted)
저장 조건: 2 · under inert gas (nitrogen or Argon) at 2–8 °C
용해도: 수용성 염기 (약간 용해됨), DMSO (약간 용해됨)
물리적 상태: 고체
산도 계수 (pKa): 3.29 · 3.29±0.10(Predicted)
색상: 페일베이지부터 라이트베이지까지

화학 및 산업

약리 정보

MeSH Pharmacological ClassificationCompounds that inhibit the enzyme activity or activation of MATRIX METALLOPROTEINASES.

응용 분야

개요S-3304 is a sulfonamide derivative that acts as a matrix metalloproteinase inhibitor.

용도S 3304, is a novel matrix metalloproteinases (MMP) inhibitor specific for MMP-2 and MMP-9.

공급사38 곳

郑州阿尔法化工有限公司+86-18530059196 · [email protected]

Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]

江苏生康迈翔科技有限公司18217475093 · [email protected]

上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]

上海冬洋生物科技有限公司0512-13601744364 13601744364

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