2-methyl-3-nitro-N-(pyridin-3-ylmethylcarbamothioyl)benzamide
概要:2-methyl-3-nitro-N-(pyridin-3-ylmethylcarbamothioyl)benzamide(CAS 430445-81-1)是一种化学化合物,分子式为C15H14N4O3S,分子量为330.08 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。
2-methyl-3-nitro-N-(pyridin-3-ylmethylcarbamothioyl)benzamide
又称:AB00112515-01, 2-methyl-3-nitro-N-(pyridin-3-ylmethylcarbamothioyl)benzamide, 2-methyl-3-nitro-N-[(pyridin-3-ylmethyl)carbamothioyl]benzamide, (2-methyl-3-nitrophenyl)-N-{[(3-pyridylmethyl)amino]thioxomethyl}carboxamide
| 分子式 | C15H14N4O3S |
|---|---|
| 分子量 | 330.08 g/mol |
| LogP | 2.10272 |
| 拓扑极性表面积 | 97.16 Ų |
| 氢键供体数 | 2 |
| 氢键受体数 | 5 |
| 可旋转键数 | 4 |
| 精确质量 | 330.07867 |
| 重原子数 | 23 |
| 复杂度 | 749.64215 |
化学标识符
| CAS 编号 | 430445-81-1 |
|---|---|
| SMILES | CC1=C(C=CC=C1[N+](=O)[O-])C(=O)NC(=S)NCC2=CN=CC=C2 |
产品概述
2-methyl-3-nitro-N-(pyridin-3-ylmethylcarbamothioyl)benzamide(CAS 430445-81-1),分子式为C15H14N4O3S,分子量为330.08 g/mol。IUPAC名:2-methyl-3-nitro-N-(pyridin-3-ylmethylcarbamothioyl)benzamide。
2-methyl-3-nitro-N-(pyridin-3-ylmethylcarbamothioyl)benzamide化学性质概览
属性洞察:2-methyl-3-nitro-N-(pyridin-3-ylmethylcarbamothioyl)benzamide
2-methyl-3-nitro-N-(pyridin-3-ylmethylcarbamothioyl)benzamide的XLogP值为2.10272,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97.16 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,2-methyl-3-nitro-N-(pyridin-3-ylmethylcarbamothioyl)benzamide有2个氢键供体和5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
2-methyl-3-nitro-N-(pyridin-3-ylmethylcarbamothioyl)benzamide的CAS号是多少?
2-methyl-3-nitro-N-(pyridin-3-ylmethylcarbamothioyl)benzamide的CAS号为430445-81-1。
2-methyl-3-nitro-N-(pyridin-3-ylmethylcarbamothioyl)benzamide的分子式是什么?
2-methyl-3-nitro-N-(pyridin-3-ylmethylcarbamothioyl)benzamide的分子式为C15H14N4O3S。
2-methyl-3-nitro-N-(pyridin-3-ylmethylcarbamothioyl)benzamide的分子量是多少?
2-methyl-3-nitro-N-(pyridin-3-ylmethylcarbamothioyl)benzamide的分子量为330.08 g/mol。
在哪里可以购买2-methyl-3-nitro-N-(pyridin-3-ylmethylcarbamothioyl)benzamide?
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科弘生物是否提供2-methyl-3-nitro-N-(pyridin-3-ylmethylcarbamothioyl)benzamide的定制合成服务?
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