기본 정보
- 표준 SMILES
Cc1c(C(=O)NC2CCCCC2)cc(-c2cc(C(F)(F)F)ccc2F)n1CC1CCCCC1O- InChIKey
MEWUEKLFXJQODU-UHFFFAOYSA-N- 분자식
- C26H32F4N2O2
- 평균 분자량
- 480.5 g/mol
- 단동위원소 질량
- 480.23999092
이름 및 식별자
- 우선 이름
- 5-(2-Fluoro-5-trifluoromethyl-phenyl)-1-((SR,2RS)-2-hydroxy-cyclohexylmethyl)-2-methyl-1H-pyrrole-3-carboxylic acid cyclohexylamide
- IUPAC
- N-cyclohexyl-5-[2-fluoro-5-(trifluoromethyl)phenyl]-1-[(2-hydroxycyclohexyl)methyl]-2-methylpyrrole-3-carboxamide
이름 및 동의어
5-(2-Fluoro-5-trifluoromethyl-phenyl)-1-((SR,2RS)-2-hydroxy-cyclohexylmethyl)-2-methyl-1H-pyrrole-3-carboxylic acid cyclohexylamideSCHEMBL39168985-(2-Fluoro-5-trifluoromethyl-phenyl)-1-((1RS,2RS)-2-hydroxy-cyclohexylmethyl)-2-methyl-1H-pyrrole-3-carboxylic acid cyclohexylamide5-(2-Fluoro-5-trifluoromethyl-phenyl)-1-((1SR,2RS)-2-hydroxy-cyclohexylmethyl)-2-methyl-1H-pyrrole-3-carboxylic acid cyclohexylamide
데이터베이스 식별자
- PubChem CID
- 10345085
물성
구조 계산 물성
- XLogP
- 5.8
- 극성 표면적
- 54.3 Ų
- 수소 결합 공여자 수
- 2
- 수소 결합 수용자 수
- 6
- 회전 가능 결합 수
- 5
- 무거운 원자 수
- 34
- 형식 전하
- 0
- 복잡도
- 684
관련 반응
4건
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