기본 정보
- CAS
1701462-59-0- 표준 SMILES
CC(C)(C)[Si](C)(C)Oc1ccc([C@@H](Nc2ccc(F)cc2)[C@@H](CC[C@H](O[Si](C)(C)C(C)(C)C)c2ccc(F)cc2)C(=O)N2C(=O)OC[C@@H]2c2ccccc2)cc1- InChIKey
NEXZCJWBWJHWQN-PRURZLHWSA-N- 분자식
- C45H58F2N2O5Si2
- 평균 분자량
- 801.1 g/mol
- 단동위원소 질량
- 800.38523235
이름 및 식별자
- 우선 이름
- (S)-3-((2R,5S)-5-((tert-Butyldimethylsilyl)oxy)-2-((S)-(4-((tert-butyldimethylsilyl)oxy)phenyl)((4-fluorophenyl)amino)methyl)-5-(4-fluorophenyl)pentanoyl)-4-phenyloxazolidin-2-one
- IUPAC
- (4S)-3-[(2R,5S)-5-[tert-butyl(dimethyl)silyl]oxy-2-[(S)-[4-[tert-butyl(dimethyl)silyl]oxyphenyl]-(4-fluoroanilino)methyl]-5-(4-fluorophenyl)pentanoyl]-4-phenyl-1,3-oxazolidin-2-one
- 영어명
- Ezetimibe Impurity 38
- 분자식
- C45H58F2N2O5Si2
- 분자량
- 801.12
이름 및 동의어
1701462-59-0(S)-3-((2R,5S)-5-((tert-Butyldimethylsilyl)oxy)-2-((S)-(4-((tert-butyldimethylsilyl)oxy)phenyl)((4-fluorophenyl)amino)methyl)-5-(4-fluorophenyl)pentanoyl)-4-phenyloxazolidin-2-oneCS-0164722(S)-3-((2R,5S)-5-((tert-butyldimethylsilyl)oxy)-2-((S)-(4-((tert-butyldimethylsilyl)oxy)phenyl)((4-fluorophenyl)amino)methyl)-5-(4-fluorophenyl)pentanoyl)-4-phenyloxazolidin-2-one? (Ezetimibe Impurity pound(c)Ezetimibe Impurity 77Ezetimibe Impurity 38Ezetimibe Impuriry 38(S)-3-((2R,5S)-5-((tert-butyldimethylsilyl)oxy)-2-((S)-(4-((tert-butyldimethylsilyl)oxy)phenyl)((4-fluorophenyl)amino)methyl)-5-(4-fluorophenyl)pentanoyl)-4-phenyloxazolidin-2-one? (Ezetimibe Impurity）2-Oxazolidinone, 3-[(2R,5S)-5-[[(1,1-dimethylethyl)dimethylsilyl]oxy]-2-[(S)-[4-[[(1,1-dimethylethyl)dimethylsilyl]oxy]phenyl][(4-fluorophenyl)amino]methyl]-5-(4-fluorophenyl)-1-oxopentyl]-4-phenyl-, (4S)-
데이터베이스 식별자
- CAS
1701462-59-0
물성
구조 계산 물성
- 극성 표면적
- 77.1 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 8
- 회전 가능 결합 수
- 16
- 무거운 원자 수
- 56
- 형식 전하
- 0
- 복잡도
- 1,260
물리화학적 성질
- 끓는 점
- 787.4 · 787.4±60.0 °C(Predicted)
- 밀도
- 1.131 · 1.131±0.06 g/cm3(Predicted)
- 산도 계수 (pKa)
- 3.29 · 3.29±0.50(Predicted)
화학 및 산업
공급사14 곳
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]
广州佳途科技股份有限公司81960175-877 18933936954 · [email protected]
南京望知星医药科技有限公司18569809817 · [email protected]
上海微佳禾生物科技有限公司17502176150; 17502176150 · [email protected]
山东大有药物研发有限公司[email protected] 15165037910 · [email protected]
怀化元研达生物技术有限责任公司18711085600; 18229999901 · [email protected]
Moxin Chemicals+86-17320513646 +86-17320513646 · [email protected]
湖北扬信医药科技有限公司15347293736 · [email protected]
台州川旭医药科技有限公司[email protected] 15165038510 · [email protected]
Standardpharm Co. Ltd.86-714-3992388 · [email protected]
湖北摩科化学有限公司18627753421; 18627756402 · [email protected]
湖北清北云研医药科技有限责任公司18162595016; 18162595016 · [email protected]
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