10-Chloro-1-(((2R)-2-(hydroxymethyl)-1-pyrrolidinyl)carbonyl)-3-phenyl-4H-benzo(a)quinolizin-4-one
기본 정보
- CAS
104604-66-2- 표준 SMILES
O=C(c1cc(-c2ccccc2)c(=O)n2ccc3ccc(Cl)cc3c12)N1CCC[C@@H]1CO- InChIKey
MAHSERINKSLHDX-LJQANCHMSA-N- 분자식
- C25H21ClN2O3
- 평균 분자량
- 432.9 g/mol
- 단동위원소 질량
- 432.1240702
개요
structure given in first source
이름 및 식별자
- 우선 이름
- 10-Chloro-1-(((2R)-2-(hydroxymethyl)-1-pyrrolidinyl)carbonyl)-3-phenyl-4H-benzo(a)quinolizin-4-one
- IUPAC
- 10-chloro-1-[(2R)-2-(hydroxymethyl)pyrrolidine-1-carbonyl]-3-phenylbenzo[a]quinolizin-4-one
이름 및 동의어
104604-66-2Ro 19-8022DTXSID20146611RefChem:907893DTXCID706910210-Chloro-1-(((2R)-2-(hydroxymethyl)-1-pyrrolidinyl)carbonyl)-3-phenyl-4H-benzo(a)quinolizin-4-oneRo-19-8022(R)-1-((10-Chloro-4-oxo-3-phenyl-4H-benzo(a)quinolizin-1-yl)carbonyl)-2-pyrrolidinemethanol1-((10-Chloro-4-oxo-3-phenyl-4H-benzo(a)quinolizin-1-yl)carbonyl)-2-pyrrolidine methanol10-chloro-1-[(2R)-2-(hydroxymethyl)pyrrolidine-1-carbonyl]-3-phenylbenzo[a]quinolizin-4-one(R)-10-Chloro-1-(2-(hydroxymethyl)pyrrolidine-1-carbonyl)-3-phenyl-4H-pyrido[2,1-a]isoquinolin-4-oneMAHSERINKSLHDX-LJQANCHMSA-N
이름 더 보기
(R)-1-[(10-chloro-4-oxo-3-phenyl-4H-benzo[a]quinolizin-1-yl)carbonyl]-2-pyrrolidinemethanolSCHEMBL9334361ro19-802210-chloro-1-[(2R)-2-(hydroxymethyl)pyrrolidine-1-carbonyl]-3-phenyl-4H-pyrido[2,1-a]isoquinolin-4-one2-Pyrrolidinemethanol, 1-((10-chloro-4-oxo-3-phenyl-4H-benzo(a)quinolizin-1-yl)carbonyl)-, (R)-COMICS-8503 (Ro-19-8022)(r)-1-[(10-chloro-4-oxo-3-phenyl-4h-benzo[a]quinolizin-1-yl)carbonyl]-2-pyrrolidine-methanol(R)-I-[(10-chloro-4-oxo-3-phenyl-4H-benzo[a]quinolizin-1-yl)carbonyl]-2-pyrrolidinemethanol
물성
구조 계산 물성
- XLogP
- 3.5
- 극성 표면적
- 60.9 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 3
- 회전 가능 결합 수
- 3
- 무거운 원자 수
- 31
- 형식 전하
- 0
- 복잡도
- 842
관련 반응
4건
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