기본 정보
- 표준 SMILES
NS(=O)(=O)c1ccc(CCNCc2cccc(-c3cccc(C(=O)NCCN4CCCC4)c3)c2)cc1- InChIKey
UAZXQLBJYJRTME-UHFFFAOYSA-N- 분자식
- C28H34N4O3S
- 평균 분자량
- 506.7 g/mol
이름 및 식별자
- 우선 이름
- 3'-[{2-[4-(aminosulfonyl)phenyl]ethyl}aminomethyl]-N-[2-(1-pyrrolidinyl)ethyl][1,1'-biphenyl]-3-carboxamide
- IUPAC
- N-(2-pyrrolidin-1-ylethyl)-3-[3-[[2-(4-sulfamoylphenyl)ethylamino]methyl]phenyl]benzamide
이름 및 동의어
SCHEMBL5578123UAZXQLBJYJRTME-UHFFFAOYSA-N3'-[{2-[4-(Aminosulfonyl)phenyl]ethyl}aminomethyl]-N-[2-(1-pyrrolidinyl) ethyl]-[1,1'-biphenyl]-3-carboxamide3'-[{2-[4-(Aminosulfonyl)phenyl]ethyl}aminomethyl]-N-[2-(1-pyrrolidinyl)-ethyl]-[1,1'-biphenyl]-3-carboxamide3'-[{2-[4-(Aminosulfonyl)phenyl]ethyl}aminomethyl]-N-[2-(1-pyrrolidinyl)ethyl]-[1,1'-biphenyl]-3-carboxamide3'-[{2-[4-(aminosulfonyl)phenyl]ethyl}aminomethyl]-N-[2-(1-pyrrolidinyl)ethyl][1,1'-biphenyl]-3-carboxamide3'-[{2[4-(aminosufonyl)phenyl]ethyl}aminomethyl]-n-[2-(1-pyrrolidinyl)ethyl][1,1'-biphenyl]-3-carboxamide
데이터베이스 식별자
- PubChem CID
- 10239248
물성
구조 계산 물성
- XLogP
- 3.2
- 극성 표면적
- 113 Ų
- 수소 결합 공여자 수
- 3
- 수소 결합 수용자 수
- 6
- 회전 가능 결합 수
- 11
- 무거운 원자 수
- 36
- 형식 전하
- 0
- 복잡도
- 772
관련 반응
6건
연결된 노트
불러오는 중…