methyl 2-(4,4,6-trimethyl-2-thioxo-3,4-dihydropyrimidin-1(2H)-yl)benzoate
概要:methyl 2-(4,4,6-trimethyl-2-thioxo-3,4-dihydropyrimidin-1(2H)-yl)benzoate(CAS 66665-67-6)是一种化学化合物,分子式为C15H18N2O2S,分子量为290.11 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。
methyl 2-(4,6,6-trimethyl-2-sulfanylidene-1H-pyrimidin-3-yl)benzoate
又称:A2297/0096821, methyl 2-(4,4,6-trimethyl-2-thioxo-3,4-dihydropyrimidin-1(2H)-yl)benzoate, methyl 2-(4,4,6-trimethyl-2-sulfanylpyrimidin-1(4H)-yl)benzoate, methyl 2-(4,6,6-trimethyl-2-sulfanylidene-1H-pyrimidin-3-yl)benzoate, 2-(4,4,6-Trimethyl-2-thioxo-3,4-dihydro-2H-pyrimidin-1-yl)-benzoic acid, methyl ester
| 分子式 | C15H18N2O2S |
|---|---|
| 分子量 | 290.11 g/mol |
| LogP | 2.5 |
| 拓扑极性表面积 | 73.7 Ų |
| 氢键供体数 | 1 |
| 氢键受体数 | 3 |
| 可旋转键数 | 3 |
| 精确质量 | 290.1089 |
| 重原子数 | 20 |
| 复杂度 | 445.0 |
化学标识符
| CAS 编号 | 66665-67-6 |
|---|---|
| SMILES | CC1=CC(NC(=S)N1C2=CC=CC=C2C(=O)OC)(C)C |
| InChIKey | SYSHOEHASGQOLJ-UHFFFAOYSA-N |
产品概述
methyl 2-(4,4,6-trimethyl-2-thioxo-3,4-dihydropyrimidin-1(2H)-yl)benzoate(CAS 66665-67-6),分子式为C15H18N2O2S,分子量为290.11 g/mol。IUPAC名:methyl 2-(4,6,6-trimethyl-2-sulfanylidene-1H-pyrimidin-3-yl)benzoate。
methyl 2-(4,4,6-trimethyl-2-thioxo-3,4-dihydropyrimidin-1(2H)-yl)benzoate化学性质概览
属性洞察:methyl 2-(4,4,6-trimethyl-2-thioxo-3,4-dihydropyrimidin-1(2H)-yl)benzoate
methyl 2-(4,4,6-trimethyl-2-thioxo-3,4-dihydropyrimidin-1(2H)-yl)benzoate的XLogP值为2.5,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73.7 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,methyl 2-(4,4,6-trimethyl-2-thioxo-3,4-dihydropyrimidin-1(2H)-yl)benzoate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
methyl 2-(4,4,6-trimethyl-2-thioxo-3,4-dihydropyrimidin-1(2H)-yl)benzoate的CAS号是多少?
methyl 2-(4,4,6-trimethyl-2-thioxo-3,4-dihydropyrimidin-1(2H)-yl)benzoate的CAS号为66665-67-6。
methyl 2-(4,4,6-trimethyl-2-thioxo-3,4-dihydropyrimidin-1(2H)-yl)benzoate的分子式是什么?
methyl 2-(4,4,6-trimethyl-2-thioxo-3,4-dihydropyrimidin-1(2H)-yl)benzoate的分子式为C15H18N2O2S。
methyl 2-(4,4,6-trimethyl-2-thioxo-3,4-dihydropyrimidin-1(2H)-yl)benzoate的分子量是多少?
methyl 2-(4,4,6-trimethyl-2-thioxo-3,4-dihydropyrimidin-1(2H)-yl)benzoate的分子量为290.11 g/mol。
在哪里可以购买methyl 2-(4,4,6-trimethyl-2-thioxo-3,4-dihydropyrimidin-1(2H)-yl)benzoate?
您可以直接向科弘生物询价methyl 2-(4,4,6-trimethyl-2-thioxo-3,4-dihydropyrimidin-1(2H)-yl)benzoate。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methyl 2-(4,4,6-trimethyl-2-thioxo-3,4-dihydropyrimidin-1(2H)-yl)benzoate的定制合成服务?
是的,科弘生物提供methyl 2-(4,4,6-trimethyl-2-thioxo-3,4-dihydropyrimidin-1(2H)-yl)benzoate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。