AM-251是通过1-(2,4-二氯苯基)-5-(4-碘苯基)-4-甲基-1H-吡唑-3-羧酸的羧基与1-哌啶胺的氨基缩合制得的羰酰肼。它是CB1大麻素受体拮抗剂。它具有抗抑郁药、抗肿瘤药物、凋亡诱导剂和CB1受体拮抗剂的作用。它是二氯苯、吡唑类、羰酰肼、有机碘化合物和氨基哌啶的成员。
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1-(2,4-dichlorophenyl)-5-(4-iodophenyl)-4-methyl-N-piperidin-1-ylpyrazole-3-carboxamide
Dangerous GoodsCAS number:183232-66-8 molecular formula:C22H21Cl2IN4O
overview
compound introduction
Specs
| Chinese alias | - | ||
| English alias | AM251 | AM-251 | KBio2_002813 | AM 251; AM-251 | AC-32778 | BDBM21279 | KBio3_000489 | N-(Piperidin-1-yl)-5-(4-iodophenyl)-1-(2, 4-dichlorophenyl)-4-methyl-1H-pyrazole-3-carboxamide | 1h-pyrazole-3-carboxamide, 1-(2,4-dichlorophenyl)-5-(4-iodophenyl)-4-me | ||
| CAS number | 183232-66-8 | molecular formula | C22H21Cl2IN4O |
| molecular weight | 555.2 | Exact mass | - |
| PSA | 50.2 | logp | 6.5 |
numbering system
| CAS | 183232-66-8 |
| UNII | 3I4FA44MAI |
| HMDB ID | HMDB0248269 |
| KEGG ID | C20220 |
| ChEBI ID | 90724 |
| Wikidata | Q4652514 |
| ChEMBL ID | CHEMBL285932 |
| AIDS 编号 | 572273 |
| PubChem CID | 2125 |
| Nikkaji Number | J1.080.914B |
| Pharos Ligand ID | 612SFTNJ6RVA |
| DSSTox Substance ID | DTXSID7042695 |
| European Community (EC) Number | 634-045-8 |
| PubChem Reference Collection SID | 505552583 |
physicochemical properties
| XLogP3 | XLogP3-AA: 6.5 |
| 复杂性 | 585 |
| Exact Mass | 554.01371 |
| 形式电荷 | 0 |
| 重原子计数 | 30 |
| Molecular Weight | 555.2 |
| Monoisotopic Mass | 554.01371 |
| 可旋转键计数 | 4 |
| 氢键供体计数 | 1 |
| 氢键受体计数 | 3 |
| 共价键单元计数 | 1 |
| 同位素原子计数 | 0 |
| 拓扑极性表面积 | 50.2 Ų |
| 定义键立体中心计数 | 0 |
| 定义原子立体中心计数 | 0 |
| 未定义键立体中心计数 | 0 |
| 未定义原子手性中心计数 | 0 |
Safety information
危害类别和分类:
STOT SE 3(95%)
Production methods and uses
purpose
工业应用参考:
工业分类参考:化学纤维制造业。
应用场景参考:可延伸到医疗、生物医药、科研院所及第三方检测等专业场景,但具体适用范围仍依赖技术条件 。
作用参考:可用于改善产品性能、稳定性或使用体验,在配方优化和质量提升中具备辅助价值 。
选型提示:实际选型应结合产品定位、纯度要求、设备精细化程度和现场环境综合判断,不宜仅凭单一指标决定 。
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MSDS
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