5-(2,6-Dimethyl-phenoxymethyl)-4-methyl-4H-[1,2,4]triazole-3-thiol
概要:5-(2,6-Dimethyl-phenoxymethyl)-4-methyl-4H-[1,2,4]triazole-3-thiol(CAS 662158-98-7)是一种化学化合物,分子式为C12H15N3OS,分子量为249.09 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。
3-[(2,6-dimethylphenoxy)methyl]-4-methyl-1H-1,2,4-triazole-5-thione
又称:5-(2,6-Dimethyl-phenoxymethyl)-4-methyl-4H-[1,2,4]triazole-3-thiol, BAS 08863078, BB 0217256, AN-648/42152201, 3-[(2,6-dimethylphenoxy)methyl]-4-methyl-1H-1,2,4-triazole-5-thione
| 分子式 | C12H15N3OS |
|---|---|
| 分子量 | 249.09 g/mol |
| LogP | 2.67353 |
| 拓扑极性表面积 | 42.84 Ų |
| 氢键供体数 | 1 |
| 氢键受体数 | 3 |
| 可旋转键数 | 3 |
| 精确质量 | 249.09358 |
| 重原子数 | 17 |
| 复杂度 | 565.42694 |
化学标识符
| CAS 编号 | 662158-98-7 |
|---|---|
| SMILES | CC1=C(C(=CC=C1)C)OCC2=NNC(=S)N2C |
产品概述
5-(2,6-Dimethyl-phenoxymethyl)-4-methyl-4H-[1,2,4]triazole-3-thiol(CAS 662158-98-7),分子式为C12H15N3OS,分子量为249.09 g/mol。IUPAC名:3-[(2,6-dimethylphenoxy)methyl]-4-methyl-1H-1,2,4-triazole-5-thione。
5-(2,6-Dimethyl-phenoxymethyl)-4-methyl-4H-[1,2,4]triazole-3-thiol化学性质概览
属性洞察:5-(2,6-Dimethyl-phenoxymethyl)-4-methyl-4H-[1,2,4]triazole-3-thiol
5-(2,6-Dimethyl-phenoxymethyl)-4-methyl-4H-[1,2,4]triazole-3-thiol的XLogP值为2.67353,表明具有中等亲脂性,在水溶性和膜透过性之间取得平衡。 5-(2,6-Dimethyl-phenoxymethyl)-4-methyl-4H-[1,2,4]triazole-3-thiol的拓扑极性表面积(TPSA)为42.84 Ų,极性较低,可能具有较好的细胞膜透过性。 根据Lipinski五规则,5-(2,6-Dimethyl-phenoxymethyl)-4-methyl-4H-[1,2,4]triazole-3-thiol有1个氢键供体和3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
5-(2,6-Dimethyl-phenoxymethyl)-4-methyl-4H-[1,2,4]triazole-3-thiol的CAS号是多少?
5-(2,6-Dimethyl-phenoxymethyl)-4-methyl-4H-[1,2,4]triazole-3-thiol的CAS号为662158-98-7。
5-(2,6-Dimethyl-phenoxymethyl)-4-methyl-4H-[1,2,4]triazole-3-thiol的分子式是什么?
5-(2,6-Dimethyl-phenoxymethyl)-4-methyl-4H-[1,2,4]triazole-3-thiol的分子式为C12H15N3OS。
5-(2,6-Dimethyl-phenoxymethyl)-4-methyl-4H-[1,2,4]triazole-3-thiol的分子量是多少?
5-(2,6-Dimethyl-phenoxymethyl)-4-methyl-4H-[1,2,4]triazole-3-thiol的分子量为249.09 g/mol。
在哪里可以购买5-(2,6-Dimethyl-phenoxymethyl)-4-methyl-4H-[1,2,4]triazole-3-thiol?
您可以直接向科弘生物询价5-(2,6-Dimethyl-phenoxymethyl)-4-methyl-4H-[1,2,4]triazole-3-thiol。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5-(2,6-Dimethyl-phenoxymethyl)-4-methyl-4H-[1,2,4]triazole-3-thiol的定制合成服务?
是的,科弘生物提供5-(2,6-Dimethyl-phenoxymethyl)-4-methyl-4H-[1,2,4]triazole-3-thiol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。