기본 정보
- 표준 SMILES
CC(C)n1ccc(NC(=O)c2cc(OCc3ccccc3)cc(O[C@@H](C)CO[Si](C)(C)C(C)(C)C)c2)n1- InChIKey
BLQOSWSGFMIHRF-QFIPXVFZSA-N- 분자식
- C29H41N3O4Si
- 평균 분자량
- 523.7 g/mol
이름 및 식별자
- 우선 이름
- 3-[((1S)-2-{[(1,1-dimethylethyl)(dimethyl)silyl]oxy}-1-methylethyl)oxy]-N-[1-(1-methylethyl)-1H-pyrazol-3-yl]-5-[(phenylmethyl)oxy]benzamide
- IUPAC
- 3-[(2S)-1-[tert-butyl(dimethyl)silyl]oxypropan-2-yl]oxy-5-phenylmethoxy-N-(1-propan-2-ylpyrazol-3-yl)benzamide
이름 및 동의어
SCHEMBL1427067BLQOSWSGFMIHRF-QFIPXVFZSA-N3-[((1S)-2-{[(1,1-dimethylethyl)(dimethyl)silyl]oxy}-1-methylethyl)oxy]-N-[1-(1-methylethyl)-1H-pyrazol-3-yl]-5-[(phenylmethyl)oxy]benzamide3-(benzyloxy)-5-((1S)-2-{[tert-butyl(dimethyl)silyl]oxy}-1-methylethoxy)-N-(1-isopropyl-1H-pyrazol-3-yl)benzamide3-[((1S)-2-{[(1,1-Dimethylethyl)(dimethyl)silyl]oxy}-1-methylethyl)oxy]-N-[1-(1 methylethyl)-1H-pyrazol-3-yl]-5-[(phenylmethyl)oxy]benzamide
데이터베이스 식별자
- PubChem CID
- 53629649
물성
구조 계산 물성
- 극성 표면적
- 74.6 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 5
- 회전 가능 결합 수
- 12
- 무거운 원자 수
- 37
- 형식 전하
- 0
- 복잡도
- 708
관련 반응
10건
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