기본 정보
- CAS
936749-12-1- 표준 SMILES
CN1CC[C@@H](c2c(O)cc(O)c3c(=O)cc(-c4ccccc4Cl)oc23)[C@@H]1CO.Cl- InChIKey
OOVTUOCTLAERQD-OJMBIDBESA-N- 분자식
- C21H21Cl2NO5
- 평균 분자량
- 438.3 g/mol
개요
Riviciclib Hydrochloride is the hydrochloride salt form of riviciclib, a flavone and cyclin dependent kinase (CDK) inhibitor with potential antineoplastic activity. Riviciclib selectively binds to and inhibits Cdk4/cyclin D1, Cdk1/cyclin B and Cdk9/cyclin T1, serine/threonine kinases that play key roles in the regulation of the cell cycle and cellular proliferation. Inhibition of these kinases leads to cell cycle arrest during the G1/S transition, thereby leading to an induction of apoptosis, and inhibition of tumor cell proliferation.
이름 및 식별자
- 우선 이름
- P 276-00
- IUPAC
- 2-(2-chlorophenyl)-5,7-dihydroxy-8-[(2R,3S)-2-(hydroxymethyl)-1-methylpyrrolidin-3-yl]chromen-4-one;hydrochloride
- 영어명
- P 276-00
- 분자식
- C21H21Cl2NO5
- 분자량
- 438.30114
이름 및 동의어
920113-03-7Riviciclib hydrochlorideP276-00DRP53ZDY6HP-27600P 276-00P-276-004H-1-Benzopyran-4-one, 2-(2-chlorophenyl)-5,7-dihydroxy-8-((2R,3S)-2-(hydroxymethyl)-1-methyl-3-pyrrolidinyl)-, hydrochloride (1:1)RefChem:928418P2762-(2-Chlorophenyl)-5,7-dihydroxy-8-((2R,3S)-2-(hydroxymethyl)-1-methylpyrrolidin-3-yl)-4H-chromen-4-one hydrochlorideRiviciclib HCl
이름 더 보기
2-(2-chlorophenyl)-5,7-dihydroxy-8-[(2R,3S)-2-(hydroxymethyl)-1-methylpyrrolidin-3-yl]chromen-4-one;hydrochlorideUNII-DRP53ZDY6H2-(2-chlorophenyl)-5,7-dihydroxy-8-[(2R,3S)-2-(hydroxymethyl)-1-methylpyrrolidin-3-yl]-4H-chromen-4-one hydrochloride920113-03-7 (HCl)SCHEMBL663220orb1685539CHEMBL3991935SCHEMBL29387962
데이터베이스 식별자
- CAS
936749-12-1- ChEMBL
CHEMBL2312181、CHEMBL3991935- UNII
- DRP53ZDY6H
물성
구조 계산 물성
- 극성 표면적
- 90.2 Ų
- 수소 결합 공여자 수
- 4
- 수소 결합 수용자 수
- 6
- 회전 가능 결합 수
- 3
- 무거운 원자 수
- 29
- 형식 전하
- 0
- 복잡도
- 628
화학 및 산업
공급사7 곳
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