2-(2-{1-[1-(1-Benzyl-4,5-dimethyl-6-oxo-1,6-dihydro-pyrimidin-2-yl)-2-methyl-propyl]-2-p-tolyl-1H-imidazol-4-yl}-ethyl)-isoindole-1,3-dione
기본 정보
- 표준 SMILES
Cc1ccc(-c2nc(CCN3C(=O)c4ccccc4C3=O)cn2C(c2nc(C)c(C)c(=O)n2Cc2ccccc2)C(C)C)cc1- InChIKey
UPBAWIFOXRREKC-UHFFFAOYSA-N- 분자식
- C37H37N5O3
- 평균 분자량
- 599.7 g/mol
이름 및 식별자
- 우선 이름
- 2-(2-{1-[1-(1-Benzyl-4,5-dimethyl-6-oxo-1,6-dihydro-pyrimidin-2-yl)-2-methyl-propyl]-2-p-tolyl-1H-imidazol-4-yl}-ethyl)-isoindole-1,3-dione
- IUPAC
- 2-[2-[1-[1-(1-benzyl-4,5-dimethyl-6-oxopyrimidin-2-yl)-2-methylpropyl]-2-(4-methylphenyl)imidazol-4-yl]ethyl]isoindole-1,3-dione
이름 및 동의어
SCHEMBL4375027UPBAWIFOXRREKC-UHFFFAOYSA-N2-(2-{1-[1-(1-Benzyl-4,5-dimethyl-6-oxo-1,6-dihydro-pyrimidin-2-yl)-2-methyl-propyl]-2-p-tolyl-1H-imidazol-4-yl}-ethyl)-isoindole-1,3-dione2-(2-{1-[1-(1-Benzyl-4,5-dimethyl-6-oxo-1,6-dihydro-pyrimidin-2-yl)-2-methyl-propyl]-2-p-tolyl-1H-imidazol-4yl}-ethyl)-isoindole-1,3-dione
데이터베이스 식별자
- PubChem CID
- 21076926
물성
구조 계산 물성
- XLogP
- 6
- 극성 표면적
- 87.9 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 5
- 회전 가능 결합 수
- 9
- 무거운 원자 수
- 45
- 형식 전하
- 0
- 복잡도
- 1,160
관련 반응
5건
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