기본 정보
- CAS
190595-66-5- 표준 SMILES
O=C1[C@H](CC[C@H](O)c2ccccc2)[C@@H](c2ccc(O)cc2)N1c1ccc(F)cc1- InChIKey
AZKGJGUGALISLD-XPWALMASSA-N- 분자식
- C24H22FNO3
- 평균 분자량
- 391.4 g/mol
- 단동위원소 질량
- 391.15837173
이름 및 식별자
- 우선 이름
- Desfluoro Ezetimibe, (3'S,3R,4S)-
- IUPAC
- (3R,4S)-1-(4-fluorophenyl)-4-(4-hydroxyphenyl)-3-[(3S)-3-hydroxy-3-phenylpropyl]azetidin-2-one
- 현지명
- EzetiMibe불순물1
- 영어명
- EzetiMibe IMpurity 1
- 분자식
- C24H22FNO3
- 분자량
- 391.43
이름 및 동의어
190595-66-557H34XFV8FDesfluoro Ezetimibe, (3'S,3R,4S)-RefChem:1083181(3R,4S)-1-(4-fluorophenyl)-3-((S)-3-hydroxy-3-phenylpropyl)-4-(4-hydroxyphenyl)azetidin-2-oneEzetiMibe IMpurity 1(3'S,3R,4S)-Desfluoro EzetimibeEzetimibe Impurity O(3R,4S)-1-(4-Fluorophenyl)-4-(4-hydroxyphenyl)-3-[(3S)-3-hydroxy-3-phenylpropyl]azetidin-2-oneEzetimibe Impurity 22(3R,4S)-1-(4-Fluorophenyl)-4-(4-hydroxyphenyl)-3-[(3S)-3-hydroxy-3-phenylpropyl]-2-azetidinone; 2-Azetidinone, 1-(4-fluorophenyl)-4-(4-hydroxyphenyl)-3-(3-hydroxy-3-phenylpropyl)-, [3R-[3a(S*),4ss]]- (9CI)MFCD28138935
이름 더 보기
EzetiMibe불순물1Ezetimibe-6Ezetimibe Imp.AEzetimibe DES F-AEzetimibe Impuriry F((3'S,3R,4S)-Desfluoro Ezetimibe)(3R,4S)-1-(4-fluorophenyl)-3-((S)Ezetimibe Desfluorobenzene Analog
(3R,4S)-1-(4-Fluorophenyl)-4-(4-hydroxyphenyl)-3-[(3S)-3-hydroxy-3-phenylpropyl]-2-azetidinoneSCHEMBL84877823'S,3R,4S)-Desfluoro Ezetimibe(3R,4S)-1-(4-fluorophenyl)-4-(4-hydroxyphenyl)-3-[(3S)-3-hydroxy-3-phenyl-propyl]azetidin-2-oneCS-0164702F19353(3R,4S)-1-(4-fluorophenyl)-3-((S)-3-hydroxy-3-phenylpropyl)-4-(4-hydroxyphenyl)azetidin-2-one? (Ezetimibe Impurity pound(c)(3R,4S)-1-(4-Fluorophenyl)-3-[(3S)-3-phenyl-3-hydroxypropyl]-4-(4-hydroxyphenyl)-2-azetidinone
물성
구조 계산 물성
- XLogP
- 3.9
- 극성 표면적
- 60.8 Ų
- 수소 결합 공여자 수
- 2
- 수소 결합 수용자 수
- 4
- 회전 가능 결합 수
- 6
- 무거운 원자 수
- 29
- 형식 전하
- 0
- 복잡도
- 536
물리화학적 성질
- 녹는점
- 55 °C · >55°C (dec.)
- 끓는 점
- 655 · 655.0±55.0 °C(Predicted)
- 밀도
- 1.293 · 1.293±0.06 g/cm3(Predicted)
- 저장 조건
- -20 °C · Hygroscopic, -20°C Freezer, Under inert atmosphere
- 용해도
- 클로로포름(약간 용해됨), 디클로로메탄(약간 용해됨), DMSO(약간 용해됨)
- 산도 계수 (pKa)
- 9.72 · 9.72±0.30(Predicted)
- 물리적 상태
- 고체
- 색상
- 흰색에서 황백색까지
- 안정성
- 흡습성
화학 및 산업
응용 분야
용도(3’S,3R,4S)-Desfluoro Ezetimibe is an impurity of the cholesterol absorption inhibitor Ezetimibe (E975000).
공급사72 곳
上海策嵘生物科技有限公司[email protected]
济南百隆化学有限公司[email protected] · [email protected]
怀化元研达生物技术有限责任公司18711085600 · [email protected]
广州隽沐生物科技股份有限公司020-36607679; 13502246435 · [email protected]
南京望知星医药科技有限公司18569809817 · [email protected]
南京世洲生物科技有限公司025-025-85560043 17301488900 · [email protected]
上海微佳禾生物科技有限公司17502176150; 17502176150 · [email protected]
Hangzhou IKSChem Technology Co., Limited13625816949 · [email protected]
Sinco Pharmachem (ShenZhen) R&D Co., Ltd.+86-18603013401 · [email protected]
济南启源生物科技有限公司18766124282; 18766124282 · [email protected]
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
广东云星生物技术有限公司0751-18902340975/189023400307 18902340307 · [email protected]
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