3-[2-methylsulfanyl-6-[[5-oxo-4-[3-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-3-yl]sulfanyl]pyrimidin-4-yl]sulfanyl-4-[3-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-5-one
概要:3-[2-methylsulfanyl-6-[[5-oxo-4-[3-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-3-yl]sulfanyl]pyrimidin-4-yl]sulfanyl-4-[3-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-5-one(CAS 883050-27-9)是一种化学化合物,分子式为C23H14F6N8O2S3,分子量为644.03 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-methylsulfanyl-6-[[5-oxo-4-[3-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-3-yl]sulfanyl]pyrimidin-4-yl]sulfanyl-4-[3-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-5-one
又称:3-[2-methylsulfanyl-6-[[5-oxo-4-[3-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-3-yl]sulfanyl]pyrimidin-4-yl]sulfanyl-4-[3-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-5-one, 5,5'-((2-(Methylthio)pyrimidine-4,6-diyl)bis(sulfanediyl))bis(4-(3-(trifluoromethyl)phenyl)-4H-1,2,4-triazol-3-ol)
| 分子式 | C23H14F6N8O2S3 |
|---|---|
| 分子量 | 644.03 g/mol |
| LogP | 5.2865 |
| 拓扑极性表面积 | 127.14 Ų |
| 氢键供体数 | 2 |
| 氢键受体数 | 9 |
| 可旋转键数 | 7 |
| 精确质量 | 644.0306 |
| 重原子数 | 42 |
| 复杂度 | 1749.2429 |
化学标识符
| CAS 编号 | 883050-27-9 |
|---|---|
| SMILES | CSC1=NC(=CC(=N1)SC2=NNC(=O)N2C3=CC=CC(=C3)C(F)(F)F)SC4=NNC(=O)N4C5=CC=CC(=C5)C(F)(F)F |
产品概述
3-[2-methylsulfanyl-6-[[5-oxo-4-[3-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-3-yl]sulfanyl]pyrimidin-4-yl]sulfanyl-4-[3-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-5-one(CAS 883050-27-9),分子式为C23H14F6N8O2S3,分子量为644.03 g/mol。IUPAC名:3-[2-methylsulfanyl-6-[[5-oxo-4-[3-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-3-yl]sulfanyl]pyrimidin-4-yl]sulfanyl-4-[3-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-5-one。
3-[2-methylsulfanyl-6-[[5-oxo-4-[3-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-3-yl]sulfanyl]pyrimidin-4-yl]sulfanyl-4-[3-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-5-one化学性质概览
属性洞察:3-[2-methylsulfanyl-6-[[5-oxo-4-[3-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-3-yl]sulfanyl]pyrimidin-4-yl]sulfanyl-4-[3-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-5-one
3-[2-methylsulfanyl-6-[[5-oxo-4-[3-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-3-yl]sulfanyl]pyrimidin-4-yl]sulfanyl-4-[3-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-5-one的XLogP值为5.2865,表明该化合物具有亲脂性(脂溶性好),可能影响其吸收、分布和配方策略。 TPSA为127.14 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,3-[2-methylsulfanyl-6-[[5-oxo-4-[3-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-3-yl]sulfanyl]pyrimidin-4-yl]sulfanyl-4-[3-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-5-one有2个氢键供体和9个氢键受体,可能需要考虑配方优化。
常见问题
常见问题
3-[2-methylsulfanyl-6-[[5-oxo-4-[3-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-3-yl]sulfanyl]pyrimidin-4-yl]sulfanyl-4-[3-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-5-one的CAS号是多少?
3-[2-methylsulfanyl-6-[[5-oxo-4-[3-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-3-yl]sulfanyl]pyrimidin-4-yl]sulfanyl-4-[3-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-5-one的CAS号为883050-27-9。
3-[2-methylsulfanyl-6-[[5-oxo-4-[3-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-3-yl]sulfanyl]pyrimidin-4-yl]sulfanyl-4-[3-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-5-one的分子式是什么?
3-[2-methylsulfanyl-6-[[5-oxo-4-[3-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-3-yl]sulfanyl]pyrimidin-4-yl]sulfanyl-4-[3-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-5-one的分子式为C23H14F6N8O2S3。
3-[2-methylsulfanyl-6-[[5-oxo-4-[3-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-3-yl]sulfanyl]pyrimidin-4-yl]sulfanyl-4-[3-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-5-one的分子量是多少?
3-[2-methylsulfanyl-6-[[5-oxo-4-[3-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-3-yl]sulfanyl]pyrimidin-4-yl]sulfanyl-4-[3-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-5-one的分子量为644.03 g/mol。
在哪里可以购买3-[2-methylsulfanyl-6-[[5-oxo-4-[3-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-3-yl]sulfanyl]pyrimidin-4-yl]sulfanyl-4-[3-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-5-one?
您可以直接向科弘生物询价3-[2-methylsulfanyl-6-[[5-oxo-4-[3-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-3-yl]sulfanyl]pyrimidin-4-yl]sulfanyl-4-[3-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-5-one。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3-[2-methylsulfanyl-6-[[5-oxo-4-[3-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-3-yl]sulfanyl]pyrimidin-4-yl]sulfanyl-4-[3-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-5-one的定制合成服务?
是的,科弘生物提供3-[2-methylsulfanyl-6-[[5-oxo-4-[3-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-3-yl]sulfanyl]pyrimidin-4-yl]sulfanyl-4-[3-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-5-one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。