4-[bis(5-hydroxy-3-methyl-1H-pyrazol-4-yl)methyl]phenyl 2-fluorobenzoate
概要:4-[bis(5-hydroxy-3-methyl-1H-pyrazol-4-yl)methyl]phenyl 2-fluorobenzoate(CAS 432515-68-9)是一种化学化合物,分子式为C22H19FN4O4,分子量为422.14 g/mol。河南科弘生物科技有限公司提供CRO/CDMO定制合成服务,支持克级到吨级规格。
[4-[bis(3-methyl-5-oxo-1,2-dihydropyrazol-4-yl)methyl]phenyl] 2-fluorobenzoate
又称:BAS 03602726, 4-[bis(5-hydroxy-3-methyl-1H-pyrazol-4-yl)methyl]phenyl 2-fluorobenzoate, 4-(bis(5-hydroxy-3-methyl-1H-pyrazol-4-yl)methyl)phenyl 2-fluorobenzoate, [4-[bis(3-methyl-5-oxo-1,2-dihydropyrazol-4-yl)methyl]phenyl] 2-fluorobenzoate
| 分子式 | C22H19FN4O4 |
|---|---|
| 分子量 | 422.14 g/mol |
| LogP | 2.87474 |
| 拓扑极性表面积 | 123.6 Ų |
| 氢键供体数 | 4 |
| 氢键受体数 | 4 |
| 可旋转键数 | 5 |
| 精确质量 | 422.13904 |
| 重原子数 | 31 |
| 复杂度 | 1306.9114 |
化学标识符
| CAS 编号 | 432515-68-9 |
|---|---|
| SMILES | CC1=C(C(=O)NN1)C(C2=CC=C(C=C2)OC(=O)C3=CC=CC=C3F)C4=C(NNC4=O)C |
产品概述
4-[bis(5-hydroxy-3-methyl-1H-pyrazol-4-yl)methyl]phenyl 2-fluorobenzoate(CAS 432515-68-9),分子式为C22H19FN4O4,分子量为422.14 g/mol。IUPAC名:[4-[bis(3-methyl-5-oxo-1,2-dihydropyrazol-4-yl)methyl]phenyl] 2-fluorobenzoate。
4-[bis(5-hydroxy-3-methyl-1H-pyrazol-4-yl)methyl]phenyl 2-fluorobenzoate化学性质概览
属性洞察:4-[bis(5-hydroxy-3-methyl-1H-pyrazol-4-yl)methyl]phenyl 2-fluorobenzoate
4-[bis(5-hydroxy-3-methyl-1H-pyrazol-4-yl)methyl]phenyl 2-fluorobenzoate的XLogP值为2.87474,表明具有中等亲脂性,在水溶性和膜透过性之间取得平衡。 TPSA为123.6 Ų,处于中等极性范围,在透过性和溶解性之间取得平衡。 根据Lipinski五规则,4-[bis(5-hydroxy-3-methyl-1H-pyrazol-4-yl)methyl]phenyl 2-fluorobenzoate有4个氢键供体和4个氢键受体,均在类药范围内,提示具有较好的口服生物利用度潜力。
常见问题
常见问题
4-[bis(5-hydroxy-3-methyl-1H-pyrazol-4-yl)methyl]phenyl 2-fluorobenzoate的CAS号是多少?
4-[bis(5-hydroxy-3-methyl-1H-pyrazol-4-yl)methyl]phenyl 2-fluorobenzoate的CAS号为432515-68-9。
4-[bis(5-hydroxy-3-methyl-1H-pyrazol-4-yl)methyl]phenyl 2-fluorobenzoate的分子式是什么?
4-[bis(5-hydroxy-3-methyl-1H-pyrazol-4-yl)methyl]phenyl 2-fluorobenzoate的分子式为C22H19FN4O4。
4-[bis(5-hydroxy-3-methyl-1H-pyrazol-4-yl)methyl]phenyl 2-fluorobenzoate的分子量是多少?
4-[bis(5-hydroxy-3-methyl-1H-pyrazol-4-yl)methyl]phenyl 2-fluorobenzoate的分子量为422.14 g/mol。
在哪里可以购买4-[bis(5-hydroxy-3-methyl-1H-pyrazol-4-yl)methyl]phenyl 2-fluorobenzoate?
您可以直接向科弘生物询价4-[bis(5-hydroxy-3-methyl-1H-pyrazol-4-yl)methyl]phenyl 2-fluorobenzoate。联系我们或发送邮件至info@kehongbio.com获取报价和库存信息。
科弘生物是否提供4-[bis(5-hydroxy-3-methyl-1H-pyrazol-4-yl)methyl]phenyl 2-fluorobenzoate的定制合成服务?
是的,科弘生物提供4-[bis(5-hydroxy-3-methyl-1H-pyrazol-4-yl)methyl]phenyl 2-fluorobenzoate及相关化合物的定制合成服务。请联系我们并告知您的具体需求,包括数量、纯度和交期。