N1-{(1S,2R)-1-(3,5-difluorobenzyl)-3-[(2-furylmethyl)amino]-2-hydroxypropyl)-5-methyl-N3,N3-dipropylisophthalamide

HCID 10280514

기본 정보

표준 SMILES
CCCN(CCC)C(=O)c1cc(C)cc(C(=O)N[C@@H](Cc2cc(F)cc(F)c2)[C@H](O)CNCc2ccco2)c1
InChIKey
BAWXNRXKOXRKLI-WUFINQPMSA-N
분자식
C30H37F2N3O4
평균 분자량
541.6 g/mol

이름 및 식별자

우선 이름
N1-{(1S,2R)-1-(3,5-difluorobenzyl)-3-[(2-furylmethyl)amino]-2-hydroxypropyl)-5-methyl-N3,N3-dipropylisophthalamide
IUPAC
1-N-[(2S,3R)-1-(3,5-difluorophenyl)-4-(furan-2-ylmethylamino)-3-hydroxybutan-2-yl]-5-methyl-3-N,3-N-dipropylbenzene-1,3-dicarboxamide

이름 및 동의어

N1-{(1S,2R)-1-(3,5-difluorobenzyl)-3-[(2-furylmethyl)amino]-2-hydroxypropyl)-5-methyl-N3,N3-dipropylisophthalamideN1-{(1S,2R)-1-(3,5-difluorobenzyl)-3-[(2-furylmethyl)amino]-2-hydroxypropyl}-5-methyl-N3,N3-dipropylisophthalamideSCHEMBL5347265BAWXNRXKOXRKLI-WUFINQPMSA-N

데이터베이스 식별자

PubChem CID
10280514

물성

구조 계산 물성

XLogP
4.6
극성 표면적
94.8 Ų
수소 결합 공여자 수
3
수소 결합 수용자 수
7
회전 가능 결합 수
14
무거운 원자 수
39

관련 반응

4건

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