Cyclohexylmethyl-5-(2,5-difluoro-phenyl)-2-methyl-1H-pyrrole-3-carboxylic acid ((1RS,2RS)-2-hydroxy-cyclohexylmethyl)-amide

HCID 72485423

기본 정보

표준 SMILES
Cc1c(C(=O)NCC2CCCCC2O)cc(-c2cc(F)ccc2F)n1CC1CCCCC1
InChIKey
DSUGJQOZJBPWIK-UHFFFAOYSA-N
분자식
C26H34F2N2O2
평균 분자량
444.6 g/mol

이름 및 식별자

우선 이름
Cyclohexylmethyl-5-(2,5-difluoro-phenyl)-2-methyl-1H-pyrrole-3-carboxylic acid ((1RS,2RS)-2-hydroxy-cyclohexylmethyl)-amide
IUPAC
1-(cyclohexylmethyl)-5-(2,5-difluorophenyl)-N-[(2-hydroxycyclohexyl)methyl]-2-methylpyrrole-3-carboxamide

이름 및 동의어

DSUGJQOZJBPWIK-UHFFFAOYSA-NCyclohexylmethyl-5-(2,5-difluoro-phenyl)-2-methyl-1H-pyrrole-3-carboxylic acid ((1RS,2RS)-2-hydroxy-cyclohexylmethyl)-amideCyclohexylmethyl-5-(2,5-difluoro-phenyl)-2-methyl-1H-pyrrole-3-carboxylic acid ((1RS,2SR)-2-hydroxy-cyclohexylmethyl)-amide

데이터베이스 식별자

PubChem CID
72485423

물성

구조 계산 물성

XLogP
6.1
극성 표면적
54.3 Ų
수소 결합 공여자 수
2
수소 결합 수용자 수
4
회전 가능 결합 수
6
무거운 원자 수
32

관련 반응

4건

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