Methyl{[5'-isopropyl-2'-methoxy-4-(trifluoromethyl)biphenyl-2-yl]methyl}[3-pyridin-4-yl-5-(trifluoromethyl)benzyl]carbamate

HCID 11657359
부분 구조 검색유사 구조 찾기

기본 정보

표준 SMILES
COC(=O)N(Cc1cc(-c2ccncc2)cc(C(F)(F)F)c1)Cc1cc(C(F)(F)F)ccc1-c1cc(C(C)C)ccc1OC
InChIKey
HVLVPNPRWLDWKZ-UHFFFAOYSA-N
분자식
C33H30F6N2O3
평균 분자량
616.6 g/mol

이름 및 식별자

우선 이름
Methyl{[5'-isopropyl-2'-methoxy-4-(trifluoromethyl)biphenyl-2-yl]methyl}[3-pyridin-4-yl-5-(trifluoromethyl)benzyl]carbamate
IUPAC
methyl N-[[2-(2-methoxy-5-propan-2-ylphenyl)-5-(trifluoromethyl)phenyl]methyl]-N-[[3-pyridin-4-yl-5-(trifluoromethyl)phenyl]methyl]carbamate

이름 및 동의어

methyl{[5'-isopropyl-2'-methoxy-4-(trifluoromethyl)biphenyl-2-yl]methyl}[3-pyridin-4-yl-5-(trifluoromethyl)benzyl]carbamateSCHEMBL3726400Methyl{[5 '-isopropyl-2'-methoxy-4-(trifluoromethyl)biphenyl-2-yl]methyl}[3-pyridin-4-yl-5-(trifluoromethyl)benzyl]carbamate

데이터베이스 식별자

PubChem CID
11657359

물성

구조 계산 물성

XLogP
8.2
극성 표면적
51.7 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
10
회전 가능 결합 수
9
무거운 원자 수
44

관련 반응

3건
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