1-(4-{[{[5-({[(4-Methoxy-2,6-dimethylphenyl)sulfonyl] (methyl)amino}methyl)furan-3-yl]carbonyl}(methyl)amino]methyl}benzyl)-N,N-dimethylpyrrolidine-3-carboxamide
기본 정보
- 표준 SMILES
COc1cc(C)c(S(=O)(=O)N(C)Cc2cc(C(=O)N(C)Cc3ccc(CN4CCC(C(=O)N(C)C)C4)cc3)co2)c(C)c1- InChIKey
BPWBZOJHKCIULN-UHFFFAOYSA-N- 분자식
- C32H42N4O6S
- 평균 분자량
- 610.8 g/mol
이름 및 식별자
- 우선 이름
- 1-(4-{[{[5-({[(4-Methoxy-2,6-dimethylphenyl)sulfonyl] (methyl)amino}methyl)furan-3-yl]carbonyl}(methyl)amino]methyl}benzyl)-N,N-dimethylpyrrolidine-3-carboxamide
- IUPAC
- 1-[[4-[[[5-[[(4-methoxy-2,6-dimethylphenyl)sulfonyl-methylamino]methyl]furan-3-carbonyl]-methylamino]methyl]phenyl]methyl]-N,N-dimethylpyrrolidine-3-carboxamide
이름 및 동의어
SCHEMBL2238832BPWBZOJHKCIULN-UHFFFAOYSA-N1-(4-{[{[5-({[(4-Methoxy-2,6-dimethylphenyl)sulfonyl] (methyl)amino}methyl)furan-3-yl]carbonyl}(methyl)amino]methyl}benzyl)-N,N-dimethylpyrrolidine-3-carboxamide1-(4-{[{[5-({[(4-Methoxy-2,6-dimethylphenyl)sulfonyl](methyl)amino}methyl)furan-3-yl]carbonyl}(methyl)amino]methyl}benzyl)-N,N-dimethylpyrrolidine-3-carboxamide
데이터베이스 식별자
- PubChem CID
- 58393307
물성
구조 계산 물성
- XLogP
- 2.8
- 극성 표면적
- 112 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 8
- 회전 가능 결합 수
- 11
- 무거운 원자 수
- 43
- 형식 전하
- 0
- 복잡도
- 1,030
관련 반응
1건
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