4-[2,2-dicyano-1-(4-nitrophenyl)ethyl]-5-hydroxy-3-methyl-1H-pyrazole-1-carbothioamide
概要:4-[2,2-dicyano-1-(4-nitrophenyl)ethyl]-5-hydroxy-3-methyl-1H-pyrazole-1-carbothioamide(CAS 351419-59-5)是一种化学化合物,分子式为C15H12N6O3S,分子量为356.07 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-[2,2-dicyano-1-(4-nitrophenyl)ethyl]-5-methyl-3-oxo-1H-pyrazole-2-carbothioamide
又称:4-[2,2-dicyano-1-(4-nitrophenyl)ethyl]-5-hydroxy-3-methyl-1H-pyrazole-1-carbothioamide, AN-329/40675096, 4-[2,2-dicyano-1-(4-nitrophenyl)ethyl]-5-methyl-3-oxo-1H-pyrazole-2-carbothioamide, 4-(2,2-Dicyano-1-(4-nitrophenyl)ethyl)-5-hydroxy-3-methyl-1H-pyrazole-1-carbothioamide, 4-(2,2-dicyano-1-{4-nitrophenyl}ethyl)-5-hydroxy-3-methyl-1H-pyrazole-1-carbothioamide
| 分子式 | C15H12N6O3S |
|---|---|
| 分子量 | 356.07 g/mol |
| LogP | 1.27998 |
| 拓扑极性表面积 | 154.53 Ų |
| 氢键供体数 | 2 |
| 氢键受体数 | 6 |
| 可旋转键数 | 4 |
| 精确质量 | 356.06915 |
| 重原子数 | 25 |
| 复杂度 | 962.6663 |
化学标识符
| CAS 编号 | 351419-59-5 |
|---|---|
| SMILES | CC1=C(C(=O)N(N1)C(=S)N)C(C2=CC=C(C=C2)[N+](=O)[O-])C(C#N)C#N |
产品概述
4-[2,2-dicyano-1-(4-nitrophenyl)ethyl]-5-hydroxy-3-methyl-1H-pyrazole-1-carbothioamide(CAS 351419-59-5),分子式为C15H12N6O3S,分子量为356.07 g/mol。IUPAC名:4-[2,2-dicyano-1-(4-nitrophenyl)ethyl]-5-methyl-3-oxo-1H-pyrazole-2-carbothioamide。
4-[2,2-dicyano-1-(4-nitrophenyl)ethyl]-5-hydroxy-3-methyl-1H-pyrazole-1-carbothioamide化学性质概览
属性洞察:4-[2,2-dicyano-1-(4-nitrophenyl)ethyl]-5-hydroxy-3-methyl-1H-pyrazole-1-carbothioamide
4-[2,2-dicyano-1-(4-nitrophenyl)ethyl]-5-hydroxy-3-methyl-1H-pyrazole-1-carbothioamide的XLogP值为1.27998,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154.53 Ų,极性较高,提示该化合物膜透过性可能受限但水溶性较好。 根据Lipinski五规则,4-[2,2-dicyano-1-(4-nitrophenyl)ethyl]-5-hydroxy-3-methyl-1H-pyrazole-1-carbothioamide有2个氢键供体和6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-[2,2-dicyano-1-(4-nitrophenyl)ethyl]-5-hydroxy-3-methyl-1H-pyrazole-1-carbothioamide的CAS号是多少?
4-[2,2-dicyano-1-(4-nitrophenyl)ethyl]-5-hydroxy-3-methyl-1H-pyrazole-1-carbothioamide的CAS号为351419-59-5。
4-[2,2-dicyano-1-(4-nitrophenyl)ethyl]-5-hydroxy-3-methyl-1H-pyrazole-1-carbothioamide的分子式是什么?
4-[2,2-dicyano-1-(4-nitrophenyl)ethyl]-5-hydroxy-3-methyl-1H-pyrazole-1-carbothioamide的分子式为C15H12N6O3S。
4-[2,2-dicyano-1-(4-nitrophenyl)ethyl]-5-hydroxy-3-methyl-1H-pyrazole-1-carbothioamide的分子量是多少?
4-[2,2-dicyano-1-(4-nitrophenyl)ethyl]-5-hydroxy-3-methyl-1H-pyrazole-1-carbothioamide的分子量为356.07 g/mol。
在哪里可以购买4-[2,2-dicyano-1-(4-nitrophenyl)ethyl]-5-hydroxy-3-methyl-1H-pyrazole-1-carbothioamide?
您可以直接向科弘生物询价4-[2,2-dicyano-1-(4-nitrophenyl)ethyl]-5-hydroxy-3-methyl-1H-pyrazole-1-carbothioamide。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-[2,2-dicyano-1-(4-nitrophenyl)ethyl]-5-hydroxy-3-methyl-1H-pyrazole-1-carbothioamide的定制合成服务?
是的,科弘生物提供4-[2,2-dicyano-1-(4-nitrophenyl)ethyl]-5-hydroxy-3-methyl-1H-pyrazole-1-carbothioamide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。