rac-(2'S,3'R,4'S,5'R)-6-chloro-4'-(3-chloro-2-fluoro-phenyl)-2'-(2,2-dimethyl-propyl)-2-oxo-1,2-dihydro-spiro[indole-3,3'-pyrrolidine]-5'-carboxylic acid (4-amino-2-methoxy-phenyl)-amide

HCID 75985813

기본 정보

표준 SMILES
COc1cc(N)ccc1NC(=O)C1NC(CC(C)(C)C)C2(C(=O)Nc3cc(Cl)ccc32)C1c1cccc(Cl)c1F
InChIKey
VDOYJAOHSZUYHZ-UHFFFAOYSA-N
분자식
C30H31Cl2FN4O3
평균 분자량
585.5 g/mol
단동위원소 질량
584.1757244

이름 및 식별자

우선 이름
rac-(2'S,3'R,4'S,5'R)-6-chloro-4'-(3-chloro-2-fluoro-phenyl)-2'-(2,2-dimethyl-propyl)-2-oxo-1,2-dihydro-spiro[indole-3,3'-pyrrolidine]-5'-carboxylic acid (4-amino-2-methoxy-phenyl)-amide
IUPAC
N-(4-amino-2-methoxyphenyl)-6-chloro-3'-(3-chloro-2-fluorophenyl)-5'-(2,2-dimethylpropyl)-2-oxospiro[1H-indole-3,4'-pyrrolidine]-2'-carboxamide

이름 및 동의어

VDOYJAOHSZUYHZ-UHFFFAOYSA-Nrac-(2'S,3'R,4'S,5'R)-6-chloro-4'-(3-chloro-2-fluoro-phenyl)-2'-(2,2-dimethyl-propyl)-2-oxo-1,2-dihydro-spiro[indole-3,3'-pyrrolidine]-5'-carboxylic acid (4-amino-2-methoxy-phenyl)-amide

데이터베이스 식별자

PubChem CID
75985813

물성

구조 계산 물성

XLogP
5.5
극성 표면적
105 Ų
수소 결합 공여자 수
4
수소 결합 수용자 수
6
회전 가능 결합 수
6
무거운 원자 수
40

관련 반응

4건

화합물 노트

불러오는 중…