1-[2-[3-(3,4-Dimethoxy-phenyl)-1-(3,4,5-trimethoxy-benzoyl)-pyrrolidin-3-yl]-ethyl]-4-phenyl-piperidine-4-carboxylic acid amide

HCID 44319249

기본 정보

표준 SMILES
COc1ccc(C2(CCN3CCC(C(N)=O)(c4ccccc4)CC3)CCN(C(=O)c3cc(OC)c(OC)c(OC)c3)C2)cc1OC
InChIKey
FMTLSROFQVSZGR-UHFFFAOYSA-N
분자식
C36H45N3O7
평균 분자량
631.8 g/mol
단동위원소 질량
631.32575078

이름 및 식별자

우선 이름
1-[2-[3-(3,4-Dimethoxy-phenyl)-1-(3,4,5-trimethoxy-benzoyl)-pyrrolidin-3-yl]-ethyl]-4-phenyl-piperidine-4-carboxylic acid amide
IUPAC
1-[2-[3-(3,4-dimethoxyphenyl)-1-(3,4,5-trimethoxybenzoyl)pyrrolidin-3-yl]ethyl]-4-phenylpiperidine-4-carboxamide

이름 및 동의어

CHEMBL854991-[2-[3-(3,4-dimethoxy-phenyl)-1-(3,4,5-trimethoxy-benzoyl)-pyrrolidin-3-yl]-ethyl]-4-phenyl-piperidine-4-carboxylic acid amide1-{2-[3-(3,4-Dimethoxy-phenyl)-1-(3,4,5-trimethoxy-benzoyl)-pyrrolidin-3-yl]-ethyl}-4-phenyl-piperidine-4-carboxylic acid amideSCHEMBL8353159FMTLSROFQVSZGR-UHFFFAOYSA-NBDBM50290296

데이터베이스 식별자

PubChem CID
44319249
ChEMBL
CHEMBL85499

물성

구조 계산 물성

XLogP
4.4
극성 표면적
113 Ų
수소 결합 공여자 수
1
수소 결합 수용자 수
8
회전 가능 결합 수
12
무거운 원자 수
46

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5건

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