tert-Butyl 2,2-dimethyl-5-((4-(5-(2'-(trifluoromethyl)biphenyl-4-yl)-1,2,4-oxadiazol-3-yl)indolin-1-yl)methyl)-1,3-dioxan-5-ylcarbamate
기본 정보
- 표준 SMILES
CC(C)(C)OC(=O)NC1(CN2CCc3c(-c4noc(-c5ccc(-c6ccccc6C(F)(F)F)cc5)n4)cccc32)COC(C)(C)OC1- InChIKey
QINLBDGWKYQACS-UHFFFAOYSA-N- 분자식
- C35H37F3N4O5
- 평균 분자량
- 650.7 g/mol
이름 및 식별자
- 우선 이름
- tert-Butyl 2,2-dimethyl-5-((4-(5-(2'-(trifluoromethyl)biphenyl-4-yl)-1,2,4-oxadiazol-3-yl)indolin-1-yl)methyl)-1,3-dioxan-5-ylcarbamate
- IUPAC
- tert-butyl N-[2,2-dimethyl-5-[[4-[5-[4-[2-(trifluoromethyl)phenyl]phenyl]-1,2,4-oxadiazol-3-yl]-2,3-dihydroindol-1-yl]methyl]-1,3-dioxan-5-yl]carbamate
이름 및 동의어
tert-Butyl 2,2-dimethyl-5-((4-(5-(2'-(trifluoromethyl)biphenyl-4-yl)-1,2,4-oxadiazol-3-yl)indolin-1-yl)methyl)-1,3-dioxan-5-ylcarbamate
데이터베이스 식별자
- PubChem CID
- 86661785
물성
구조 계산 물성
- XLogP
- 6.9
- 극성 표면적
- 99 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 11
- 회전 가능 결합 수
- 8
- 무거운 원자 수
- 47
- 형식 전하
- 0
- 복잡도
- 1,070
관련 반응
1건
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