6-chloro-4'-[5-fluoro-2-(2-methanesulfonylamino-1,1-dimethyl-2-oxo-ethoxy)-phenyl]-2'-(5-fluoro-2-methyl-phenyl)spiro[3H-indole-3,3'-piperidine]-2,6'(1H)-dione
기본 정보
- 표준 SMILES
Cc1ccc(F)cc1C1NC(=O)CC(c2cc(F)ccc2OC(C)(C)C(=O)NS(C)(=O)=O)C12C(=O)Nc1cc(Cl)ccc12- InChIKey
QMPTWGUTHZTOQI-UHFFFAOYSA-N- 분자식
- C30H28ClF2N3O6S
- 평균 분자량
- 632.1 g/mol
이름 및 식별자
- 우선 이름
- 6-chloro-4'-[5-fluoro-2-(2-methanesulfonylamino-1,1-dimethyl-2-oxo-ethoxy)-phenyl]-2'-(5-fluoro-2-methyl-phenyl)spiro[3H-indole-3,3'-piperidine]-2,6'(1H)-dione
- IUPAC
- 2-[2-[6-chloro-2'-(5-fluoro-2-methylphenyl)-2,6'-dioxospiro[1H-indole-3,3'-piperidine]-4'-yl]-4-fluorophenoxy]-2-methyl-N-methylsulfonylpropanamide
이름 및 동의어
QMPTWGUTHZTOQI-UHFFFAOYSA-N6-chloro-4'-[5-fluoro-2-(2-methanesulfonylamino-1,1-dimethyl-2-oxo-ethoxy)-phenyl]-2'-(5-fluoro-2-methyl-phenyl)spiro[3H-indole-3,3'-piperidine]-2,6'(1H)-dioneRacemic (2'S,3S,4'R)-6-chloro-4'-[5-fluoro-2-(2-methanesulfonylamino-1,1-dimethyl-2-oxo-ethoxy)-phenyl]-2'-(5-fluoro-2-methyl-phenyl)spiro[3H-indole-3,3'-piperidine]-2,6'(1H)-dione
데이터베이스 식별자
- PubChem CID
- 74928462
물성
구조 계산 물성
- XLogP
- 3.6
- 극성 표면적
- 139 Ų
- 수소 결합 공여자 수
- 3
- 수소 결합 수용자 수
- 8
- 회전 가능 결합 수
- 6
- 무거운 원자 수
- 43
- 형식 전하
- 0
- 복잡도
- 1,220
관련 반응
2건
화합물 노트
불러오는 중…