N-[(6S)-8-Fluoro-5,6-dihydro-4-(1-methylethyl)-6-[(2S,4R)-tetrahydro-4-hydroxy-6-oxo-2H-pyran-2-yl]benzo[h]quinazolin-2-yl]-N-methylmethanesulfonamide
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기본 정보
- CAS
854898-47-8- 표준 SMILES
CC(C)c1nc(N(C)S(C)(=O)=O)nc2c1C[C@H]([C@@H]1C[C@@H](O)CC(=O)O1)c1cc(F)ccc1-2- InChIKey
VLAHUUGOOLLUEH-SKDZVZGDSA-N- 분자식
- C22H26FN3O5S
- 평균 분자량
- 463.5 g/mol
이름 및 식별자
- 우선 이름
- N-[(6S)-8-Fluoro-5,6-dihydro-4-(1-methylethyl)-6-[(2S,4R)-tetrahydro-4-hydroxy-6-oxo-2H-pyran-2-yl]benzo[h]quinazolin-2-yl]-N-methylmethanesulfonamide
- IUPAC
- N-[(6S)-8-fluoro-6-[(2S,4R)-4-hydroxy-6-oxooxan-2-yl]-4-propan-2-yl-5,6-dihydrobenzo[h]quinazolin-2-yl]-N-methylmethanesulfonamide
- 영어명
- N-[(6S)-8-Fluoro-5,6-dihydro-4-(1-Methylethyl)-6-[(2S,4R)-tetrahydro-4-hydroxy-6-oxo-2H-pyran-2-yl]benzo[h]quinazolin-2-yl]-N-MethylMethanesulfonaMide
- 분자식
- C22H26FN3O5S
- 분자량
- 463.52
이름 및 동의어
854898-47-8N-[(6S)-8-Fluoro-5,6-dihydro-4-(1-methylethyl)-6-[(2S,4R)-tetrahydro-4-hydroxy-6-oxo-2H-pyran-2-yl]benzo[h]quinazolin-2-yl]-N-methylmethanesulfonamideN-[(6S)-8-fluoro-6-[(2S,4R)-4-hydroxy-6-oxooxan-2-yl]-4-propan-2-yl-5,6-dihydrobenzo[h]quinazolin-2-yl]-N-methylmethanesulfonamideRosuvastatin Impurity 4;Rosuvastatin (6S)-Lactone ImpurityN-[(6S)-8-Fluoro-5,6-dihydro-4-(1-methylethyl)-6-[(2S,4R)-tetrahydro-4-hydroxy-6-oxo-2H-pyran-2-yl]bDB-265996CS-0165294N-((S)-8-fluoro-6-((2S,4R)-4-hydroxy-6-oxotetrahydro-2H-pyran-2-yl)-4-isopropyl-5,6-dihydrobenzo[h]quinazolin-2-yl)-N-methylmethanesulfonamideN-((S)-8-fluoro-6-((2S,4R)-4-hydroxy-6-oxotetrahydro-2H-pyran-2-yl)-4-isopropyl-5,6-dihydrobenzo[h]quinazolin-2-yl)-N-methylmethanesulfonamide? (Rosuvastatin Impurity pound(c)Rosuvastatin calcium-16Rosuvastatin EP Impurity 36
이름 더 보기
Rosuvastatin calcium impurity 36Rosuvastatin Lactone degradation impurity 2
물성
구조 계산 물성보충 중
- XLogP
- 2.1
- 극성 표면적
- 118 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 9
- 회전 가능 결합 수
- 4
- 무거운 원자 수
- 32
- 형식 전하
- 0
- 복잡도
- 806
물리화학적 성질
- 녹는점
- 72 oC · >72oC (dec.)
- 저장 조건
- Refrigerator
- 용해도
- 클로로포름(약간 용해됨), 메탄올(약간 용해됨)
- 물리적 상태
- 고체
- 색상
- 황백색에서 연한 노란색
화학 및 산업
응용 분야
용도N-[(6S)-8-Fluoro-5,6-dihydro-4-(1-methylethyl)-6-[(2S,4R)-tetrahydro-4-hydroxy-6-oxo-2H-pyran-2-yl]benzo[h]quinazolin-2-yl]-N-methylmethanesulfonamide is an impurity of the HMG-CoA reductase inhibitor Rosuvastatin (R700500).
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