기본 정보
- 표준 SMILES
Cc1cc(C)cc(-c2c(OCCC3CCCCN3C(=O)OCC[Si](C)(C)C)c3cc(-n4nn[nH]c4=O)c(Cl)cc3[nH]c2=O)c1- InChIKey
QROHNNQWGQQZAS-UHFFFAOYSA-N- 분자식
- C31H39ClN6O5Si
- 평균 분자량
- 639.2 g/mol
이름 및 식별자
- 우선 이름
- 2-{2-[7-Chloro-3-(3,5-dimethylphenyl)-2-oxo-6-(5-oxo-4,5-dihydro-tetrazol-1-yl)-1,2-dihydro-quinolin-4-yloxy]-ethyl}-piperidine-1-carboxylic acid 2-trimethylsilanylethyl ester
- IUPAC
- 2-trimethylsilylethyl 2-[2-[[7-chloro-3-(3,5-dimethylphenyl)-2-oxo-6-(5-oxo-1H-tetrazol-4-yl)-1H-quinolin-4-yl]oxy]ethyl]piperidine-1-carboxylate
이름 및 동의어
SCHEMBL8185925QROHNNQWGQQZAS-UHFFFAOYSA-N2-{2-[7-chloro-3-(3,5-dimethylphenyl)-2-oxo-6-(5-oxo-4,5-dihydro-tetrazol-1-yl) -1,2-dihydro-quinolin-4-yloxy]-ethyl}-piperidine-1-carboxylic acid 2-trimethylsilanylethyl ester2-{2-[7-chloro-3-(3,5-dimethylphenyl)-2-oxo-6-(5-oxo-4,5-dihydro-tetrazol-1-yl)-1,2-dihydro-quinolin-4-yloxy]-ethyl}-piperidine-1-carboxylic acid 2-trimethylsilanylethyl ester
데이터베이스 식별자
- PubChem CID
- 136333719
물성
구조 계산 물성
- 극성 표면적
- 125 Ų
- 수소 결합 공여자 수
- 2
- 수소 결합 수용자 수
- 7
- 회전 가능 결합 수
- 10
- 무거운 원자 수
- 44
- 형식 전하
- 0
- 복잡도
- 1,140
관련 반응
2건
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