沙格列汀一水合物（CAS 945667-22-1）：分子式 C18H25N3O2、分子量 315.4。
| CAS号 | 945667-22-1 |
|---|---|
| 分子式 | C18H25N3O2 |
| 分子量 | 315.4 |
| LogP | 0.7 |
| 应用领域 | Uses: MEDICATION、Methods of Manufacturing: Preparation: J. A. Robl et al.、World Intellectual Property Organization patent 0168603、eidem、United States of America patent 6395767 (2001、2002 both to Bristol-Myers Squibb).、Formulations、Preparations: Table: Saxagliptin Hydrochloride Preparations [Table#8180]、Table: Saxagliptin Hydrochloride Combinations Preparations [Table#8181] |
登记用途：Uses: MEDICATION、Methods of Manufacturing: Preparation: J. A. Robl et al.、World Intellectual Property Organization patent 0168603、eidem、United States of America patent 6395767 (2001、2002 both to Bristol-Myers Squibb).、Formulations、Preparations: Table: Saxagliptin Hydrochloride Preparations [Table#8180]、Table: Saxagliptin Hydrochloride Combinations Preparations [Table#8181]。
沙格列汀一水合物 是一种化工化合物，登记 CAS 号为 945667-22-1，分子式 C18H25N3O2（分子量 315.4）。
登记 CAS 号：945667-22-1
其分子式 C18H25N3O2 由 18 个碳、25 个氢、3 个氮、2 个氧 组成。
别名/同义词：沙格列汀一水合物 · Saxagliptin monohydrate
沙格列汀一水合物 的 CAS 登记号为 945667-22-1。
分子式 C18H25N3O2，分子量 315.4。
别名/同义词：沙格列汀一水合物、Saxagliptin monohydrate。
登记用途：Uses: MEDICATION、Methods of Manufacturing: Preparation: J. A. Robl et al.、World Intellectual Property Organization patent 0168603、eidem、United States of America patent 6395767 (2001、2002 both to Bristol-Myers Squibb).、Formulations、Preparations: Table: Saxagliptin Hydrochloride Preparations [Table#8180]、Table: Saxagliptin Hydrochloride Combinations Preparations [Table#8181]。
沙格列汀一水合物（CAS 945667-22-1）的独立参考数据，整理自公开化学数据库。
| CAS Registry Number | 945667-22-1 |
|---|---|
| PubChem CID | 11243969 |
| Molecular formula | C18H25N3O2 |
| IUPAC name | (1S,3S,5S)-2-[(2S)-2-amino-2-(3-hydroxy-1-adamantyl)acetyl]-2-azabicyclo[3.1.0]hexane-3-carbonitrile |
| UNII (FDA) | 8I7IO46IVQ |
| Molecular Weight | 315.4 |
|---|---|
| XLogP3 | 0.7 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 2 |
| Exact Mass | 315.19467705 |
| Monoisotopic Mass | 315.19467705 |
| Topological Polar Surface Area | 90.4 |
| Heavy Atom Count | 23 |
Saxagliptin; 361442-04-8; BMS-477118; Saxagliptin anhydrous; BMS 477118; Saxagliptine; DTXSID7048580; 8I7IO46IVQ; (1S,3S,5S)-2-[(2S)-2-amino-2-(3-hydroxy-1-adamantyl)acetyl]-2-azabicyclo[3.1.0]hexane-3-carbonitrile; DTXCID3028506; BMS477118; CHEBI:71272; Saxagliptina; NSC760407; (1S,3S,5S)-2-[(2S)-2-amino-2-(3-hydroxyadamantan-1-yl)acetyl]-2-azabicyclo[3.1.0]hexane-3-carbonitrile; NSC-760407
| Reported hazard statements | H317 (100%), H334 (100%), H372 (100%) |
|---|
H317 (100%): May cause an allergic skin reaction [Warning Sensitization, Skin]
H334 (100%): May cause allergy or asthma symptoms or breathing difficulties if inhaled [Danger Sensitization, respiratory]
Saxagliptin monohydrate · CAS 945667-22-1 · C18H25N3O2. UNII 8I7IO46IVQ.
数据来源：PubChem / Wikidata；与随货 COA 不一致时以 COA 为准。
English page: Saxagliptin monohydrate