N-(4-chlorobenzyl)-2-{[(2-hydroxy-2-pyrazin-2-ylethyl)(methyl)amino]methyl}-4-methyl-7-oxo-3-{[2-(trimethylsilyl)ethoxy]methyl}-4,7-dihydrothieno[3,2-b]pyridine-6-carboxamide
기본 정보
- 표준 SMILES
CN(Cc1sc2c(=O)c(C(=O)NCc3ccc(Cl)cc3)cn(C)c2c1COCC[Si](C)(C)C)CC(O)c1cnccn1- InChIKey
CBISJCQQTKFFAT-UHFFFAOYSA-N- 분자식
- C30H38ClN5O4SSi
- 평균 분자량
- 628.3 g/mol
이름 및 식별자
- 우선 이름
- N-(4-chlorobenzyl)-2-{[(2-hydroxy-2-pyrazin-2-ylethyl)(methyl)amino]methyl}-4-methyl-7-oxo-3-{[2-(trimethylsilyl)ethoxy]methyl}-4,7-dihydrothieno[3,2-b]pyridine-6-carboxamide
- IUPAC
- N-[(4-chlorophenyl)methyl]-2-[[(2-hydroxy-2-pyrazin-2-ylethyl)-methylamino]methyl]-4-methyl-7-oxo-3-(2-trimethylsilylethoxymethyl)thieno[3,2-b]pyridine-6-carboxamide
이름 및 동의어
SCHEMBL6318783CBISJCQQTKFFAT-UHFFFAOYSA-NN-(4-chlorobenzyl)-2-{[(2-hydroxy-2-pyrazin-2-ylethyl)(methyl)amino]methyl}-4-methyl-7-oxo-3-{[2-(trimethylsilyl)ethoxy]methyl}-4,7-dihydrothieno[3,2-b]pyridine-6-carboxamide
데이터베이스 식별자
- PubChem CID
- 22574381
물성
구조 계산 물성
- 극성 표면적
- 136 Ų
- 수소 결합 공여자 수
- 2
- 수소 결합 수용자 수
- 9
- 회전 가능 결합 수
- 13
- 무거운 원자 수
- 42
- 형식 전하
- 0
- 복잡도
- 947
관련 반응
2건
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