(3R,4R)-methyl 4-(3-(6-methoxyquinolin-4-yl)-3-oxopropyl)piperidine-3-carboxylate
기본 정보
- CAS
333782-30-2- 표준 SMILES
COC(=O)[C@H]1CNCC[C@H]1CCC(=O)c1ccnc2ccc(OC)cc12- InChIKey
SGFHXWJMYMNURF-DYVFJYSZSA-N- 분자식
- C20H24N2O4
- 평균 분자량
- 356.4 g/mol
- 단동위원소 질량
- 356.17360725
이름 및 식별자
- 우선 이름
- (3R,4R)-methyl 4-(3-(6-methoxyquinolin-4-yl)-3-oxopropyl)piperidine-3-carboxylate
- IUPAC
- methyl (3R,4R)-4-[3-(6-methoxyquinolin-4-yl)-3-oxopropyl]piperidine-3-carboxylate
이름 및 동의어
333782-30-2(3R,4R)-methyl 4-(3-(6-methoxyquinolin-4-yl)-3-oxopropyl)piperidine-3-carboxylatemethyl (3R,4R)-4-[3-(6-methoxyquinolin-4-yl)-3-oxopropyl]piperidine-3-carboxylate3-Piperidinecarboxylic acid, 4-[3-(6-methoxy-4-quinolinyl)-3-oxopropyl]-, methyl ester, (3R,4R)-Methyl (3R,4R)-4-(3-(6-methoxyquinolin-4-yl)-3-oxopropyl)piperidine-3-carboxylateSCHEMBL449533DTXSID90692872SGFHXWJMYMNURF-DYVFJYSZSA-Nmethyl (3R,4R)-4-[3-oxo-3-(6-methoxyquinolin-4-yl)propyl]piperidine-3-carboxylate
데이터베이스 식별자
- CAS
333782-30-2- PubChem CID
- 53238173
- DTXSID
DTXSID90692872
물성
구조 계산 물성
- XLogP
- 2
- 극성 표면적
- 77.5 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 6
- 회전 가능 결합 수
- 7
- 무거운 원자 수
- 26
- 형식 전하
- 0
- 복잡도
- 498
관련 반응
5건
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