기본 정보
- 표준 SMILES
Cc1[nH]c(C=C2C(=O)Nc3ccc(S(=O)(=O)Nc4cccc(Cl)c4)cc32)c(C)c1C(=O)NCCN1CCCC1- InChIKey
VNPRAAZGEZFNTJ-UHFFFAOYSA-N- 분자식
- C28H30ClN5O4S
- 평균 분자량
- 568.1 g/mol
이름 및 식별자
- 우선 이름
- 5-[5-(3-Chlorophenylsulfamoyl)-2-oxo-1,2-dihydroindol-3-ylidenemethyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid (2-pyrrolidin-1-ylethyl)amide
- IUPAC
- 5-[[5-[(3-chlorophenyl)sulfamoyl]-2-oxo-1H-indol-3-ylidene]methyl]-2,4-dimethyl-N-(2-pyrrolidin-1-ylethyl)-1H-pyrrole-3-carboxamide
이름 및 동의어
SCHEMBL2115618VNPRAAZGEZFNTJ-UHFFFAOYSA-N5- [5-(3-Chlorophenylsulfamoyl)-2-oxo-1,2-dihydroindol-3-ylidenemethyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid (2-pyrrolidin-1-ylethyl)amide5-[5-(3-Chlorophenylsulfamoyl)-2-oxo-1,2-dihydroindol-3-ylidenemethyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid (2-pyrrolidin-1-ylethyl)amide5-[5-(3-Chlorophenylsulfamoyl)-2-oxo-1,2-dihydroindol-3-ylidenemethyl]2,4-dimethyl-1H-pyrrole-3-carboxylic acid (2-pyrrolidin-1-ylethyl)amide
데이터베이스 식별자
- PubChem CID
- 67281583
물성
구조 계산 물성
- XLogP
- 3.4
- 극성 표면적
- 132 Ų
- 수소 결합 공여자 수
- 4
- 수소 결합 수용자 수
- 6
- 회전 가능 결합 수
- 8
- 무거운 원자 수
- 39
- 형식 전하
- 0
- 복잡도
- 1,040
관련 반응
8건
화합물 노트
불러오는 중…