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3-[2-[4-(4-fluorobenzoyl)piperidin-1-yl]ethyl]-2-methylpyrido[1,2-a]pyrimidin-4-one
CAS number：75444-65-4 molecular formula：C23H24FN3O2
overview
Specs
| Chinese alias | - | ||
| English alias | 3-(2-(4-(4-FLUOROBENZOYL)PIPERIDIN-1-YL)ETHYL)-2-METHYL-4H-PYRIDO(1,2-A)PYRIMIDIN-4-ONE | DTXCID7025182 | SBI-0050980.P003 | SPBio_002462 | Spectrum3_001655 | NCGC00015784-04 | CAS-75444-65-4 | HMS2096L03 | NCGC00178084-01 | HMS3713L03 | KBio2_002064 | NC | ||
| CAS number | 75444-65-4 | molecular formula | C23H24FN3O2 |
| molecular weight | 393.5 | Exact mass | - |
| PSA | 53 | logp | 2.6 |
numbering system
| CAS | 75444-65-4 |
| UNII | Y9FMC4513X |
| HMDB ID | HMDB0256592 |
| KEGG ID | D05495 |
| ChEBI ID | 92444 |
| Wikidata | Q27088400 |
| ChEMBL ID | CHEMBL18331 |
| Wikipedia | Pirenperone |
| NSC Number | NSC Number: NSC760095 |
| DrugBank ID | DB21405 |
| PubChem CID | 4847 |
| Nikkaji Number | J3.520C |
| NCI 词表代码 | 吡哌环庚是一种碳三环化合物和N-烷基吡咯烷。它具有抗帕金森药物和毒蕈碱拮抗剂的作用。它是吡哌环庚(1+)的共轭碱。 |
| Pharos Ligand ID | 4P423H3564DR |
| DSSTox Substance ID | DTXSID9045182 |
| Metabolomics Workbench ID | 144610 |
| European Community (EC) Number | 278-213-5 |
| PubChem Reference Collection SID | 516575254 |
| United States Adopted Name (USAN) | PIRENPERONE |
| International Nonproprietary Names (INN) | PIRENPERONE |
physicochemical properties
| XLogP3 | 2.6 |
| 复杂性 | 782 |
| Exact Mass | 393.18525518 |
| 形式电荷 | 0 |
| 重原子计数 | 29 |
| Molecular Weight | 393.5 |
| Monoisotopic Mass | 393.18525518 |
| 可旋转键计数 | 5 |
| 氢键供体计数 | 0 |
| 氢键受体计数 | 5 |
| 共价键单元计数 | 1 |
| 同位素原子计数 | 0 |
| 拓扑极性表面积 | 53 Ų |
| Collision Cross Section | C76002 |
| 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
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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：适用于产品性能验证、质量检测和过程控制等应用环节，可作为检测相关材料或实验耗材使用 。
作用参考：在科研材料体系中具备较强的组合应用潜力，价值往往取决于具体配方、纯度等级和工艺设计 。
选型提示：涉及安全应用管理时，仍应以 MSDS、产品详情页和现场工艺控制要求为准，不应由参考文案替代 。
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MSDS
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