4-([(4'-Difluoromethoxy-biphenyl-4-yl)-methyl-amino]-methyl)-5-methyl-furan-2-carboxylic acid

HCID 18444565

기본 정보

표준 SMILES
Cc1oc(C(=O)O)cc1CN(C)c1ccc(-c2ccc(OC(F)F)cc2)cc1
InChIKey
AKDYETVPYDYEJE-UHFFFAOYSA-N
분자식
C21H19F2NO4
평균 분자량
387.4 g/mol

이름 및 식별자

우선 이름
4-([(4'-Difluoromethoxy-biphenyl-4-yl)-methyl-amino]-methyl)-5-methyl-furan-2-carboxylic acid
IUPAC
4-[[4-[4-(difluoromethoxy)phenyl]-N-methylanilino]methyl]-5-methylfuran-2-carboxylic acid

이름 및 동의어

4-([(4'-Difluoromethoxy-biphenyl-4-yl)-methyl-amino]-methyl)-5-methyl-furan-2-carboxylic acid4-([(4'-Difluoromethoxy-biphenyl-4-yl)-methyl-amino]-methyl}-5-methyl-furan-2-carboxylic acid4-{[(4'-difluoromethoxy-biphenyl-4-yl)-methyl-amino]-methyl}-5-methyl-furan-2-carboxylic acidSCHEMBL3536223

데이터베이스 식별자

PubChem CID
18444565

물성

구조 계산 물성

XLogP
5.4
극성 표면적
62.9 Ų
수소 결합 공여자 수
1
수소 결합 수용자 수
7
회전 가능 결합 수
7
무거운 원자 수
28

관련 반응

9건

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