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 (2-methoxy-4-nitro-phenyl)-amide

HCID 75985747

기본 정보

표준 SMILES
COc1cc([N+](=O)[O-])ccc1NC(=O)C1NC(CC(C)(C)C)C2(C(=O)Nc3cc(Cl)ccc32)C1c1cccc(Cl)c1F
InChIKey
PUTIJTBEHVRZJW-UHFFFAOYSA-N
분자식
C30H29Cl2FN4O5
평균 분자량
615.5 g/mol

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 (2-methoxy-4-nitro-phenyl)-amide
IUPAC
6-chloro-3'-(3-chloro-2-fluorophenyl)-5'-(2,2-dimethylpropyl)-N-(2-methoxy-4-nitrophenyl)-2-oxospiro[1H-indole-3,4'-pyrrolidine]-2'-carboxamide

이름 및 동의어

PUTIJTBEHVRZJW-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 (2-methoxy-4-nitro-phenyl)-amide

데이터베이스 식별자

PubChem CID
75985747

물성

구조 계산 물성

XLogP
6
극성 표면적
125 Ų
수소 결합 공여자 수
3
수소 결합 수용자 수
7
회전 가능 결합 수
6
무거운 원자 수
42

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