Tert-butyl 4-(3-((R)-3-(((S)-3-(tert-butoxy)-3-oxo-1-(4-(2-(tosyloxy)ethoxy)phenyl)propyl)carbamoyl)piperidin-1-YL)-3-oxopropyl)piperidine-1-carboxylate
기본 정보
- 표준 SMILES
Cc1ccc(S(=O)(=O)OCCOc2ccc([C@H](CC(=O)OC(C)(C)C)NC(=O)[C@@H]3CCCN(C(=O)CCC4CCN(C(=O)OC(C)(C)C)CC4)C3)cc2)cc1- InChIKey
XLFAWIUZUADGIM-LDNVYYCDSA-N- 분자식
- C41H59N3O10S
- 평균 분자량
- 786 g/mol
- 단동위원소 질량
- 785.39211626
이름 및 식별자
- 우선 이름
- Tert-butyl 4-(3-((R)-3-(((S)-3-(tert-butoxy)-3-oxo-1-(4-(2-(tosyloxy)ethoxy)phenyl)propyl)carbamoyl)piperidin-1-YL)-3-oxopropyl)piperidine-1-carboxylate
- IUPAC
- tert-butyl 4-[3-[(3R)-3-[[(1S)-1-[4-[2-(4-methylphenyl)sulfonyloxyethoxy]phenyl]-3-[(2-methylpropan-2-yl)oxy]-3-oxopropyl]carbamoyl]piperidin-1-yl]-3-oxopropyl]piperidine-1-carboxylate
이름 및 동의어
1423134-34-2TERT-BUTYL 4-(3-((R)-3-(((S)-3-(TERT-BUTOXY)-3-OXO-1-(4-(2-(TOSYLOXY)ETHOXY)PHENYL)PROPYL)CARBAMOYL)PIPERIDIN-1-YL)-3-OXOPROPYL)PIPERIDINE-1-CARBOXYLATESCHEMBL14699516XLFAWIUZUADGIM-LDNVYYCDSA-NAT42825tert-butyl 4-{3-[(3R)-3-({(1S)-3-tert-butoxy-1-[4-(2-{[(4-methylphenyl)sulfonyl]oxy}ethoxy)phenyl]-3-oxopropyl}carbamoyl)piperidin-1-yl]-3-oxopropyl}piperidine-1-carboxylate
데이터베이스 식별자
- PubChem CID
- 89407760
물성
구조 계산 물성
- XLogP
- 5.1
- 극성 표면적
- 166 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 10
- 회전 가능 결합 수
- 18
- 무거운 원자 수
- 55
- 형식 전하
- 0
- 복잡도
- 1,360
관련 반응
1건
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