2-[3,5-bis(trifluoromethyl)phenyl]-N-(6-[(7S,9aS)-7-({[(1,1-dimethylethyl)(dimethyl)silyl]oxy}methyl)hexahydropyrazino[2,1-c][1,4]oxazin-8(1H)-yl]-4-[2-(hydroxymethyl)phenyl]-3-pyridinyl}-N,2-dimethylpropanamide
데이터를 보충하는 중입니다. 잠시 후 페이지를 새로 고치면 최신 내용을 볼 수 있습니다
기본 정보
- 표준 SMILES
CN(C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1cnc(N2C[C@H]3COCCN3C[C@H]2CO[Si](C)(C)C(C)(C)C)cc1-c1ccccc1CO- InChIKey
CEVJAUVIGXBQQM-KYJUHHDHSA-N- 분자식
- C39H50F6N4O4Si
- 평균 분자량
- 780.9 g/mol
이름 및 식별자
- 우선 이름
- 2-[3,5-bis(trifluoromethyl)phenyl]-N-(6-[(7S,9aS)-7-({[(1,1-dimethylethyl)(dimethyl)silyl]oxy}methyl)hexahydropyrazino[2,1-c][1,4]oxazin-8(1H)-yl]-4-[2-(hydroxymethyl)phenyl]-3-pyridinyl}-N,2-dimethylpropanamide
- IUPAC
- N-[6-[(7S,9aS)-7-[[tert-butyl(dimethyl)silyl]oxymethyl]-3,4,6,7,9,9a-hexahydro-1H-pyrazino[2,1-c][1,4]oxazin-8-yl]-4-[2-(hydroxymethyl)phenyl]-3-pyridinyl]-2-[3,5-bis(trifluoromethyl)phenyl]-N,2-dimethylpropanamide
이름 및 동의어
2-[3,5-bis(trifluoromethyl)phenyl]-N-(6-[(7S,9aS)-7-({[(1,1-dimethylethyl)(dimethyl)silyl]oxy}methyl)hexahydropyrazino[2,1-c][1,4]oxazin-8(1H)-yl]-4-[2-(hydroxymethyl)phenyl]-3-pyridinyl}-N,2-dimethylpropanamide2-[3,5-bis(trifluoromethyl)phenyl]-N-{6-[(7S,9aS)-7-({[(1,1-dimethylethyl)(dimethyl)silyl]oxy}methyl)hexahydropyrazino[2,1-c][1,4]oxazin-8(1H)-yl]-4-[2-(hydroxymethyl)phenyl]-3-pyridinyl}-N,2-dimethylpropanamideSCHEMBL3373502-[3,5-bis(trifluoromethyl)phenyl]-N-{6-[(7S ,9aS)-7-({[(1,1-dimethylethyl)(dimethyl)silyl]oxy}methyl)hexahydropyrazino[2,1-c][1,4]oxazin-8(1H) -yl]-4-[2-(hydroxymethyl)phenyl]-3-pyridinyl}-N ,2-dimethylpropanamide
데이터베이스 식별자
- PubChem CID
- 59215842
물성
구조 계산 물성보충 중
- 극성 표면적
- 78.4 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 13
- 회전 가능 결합 수
- 10
- 무거운 원자 수
- 54
- 형식 전하
- 0
- 복잡도
- 1,240
관련 반응
6건
화합물 노트
불러오는 중…