5-hydroxy-1-[(4-methylphenyl)sulfonyl]-2H,3H-benzo[f]azepine-4-carbonitrile
概要:5-hydroxy-1-[(4-methylphenyl)sulfonyl]-2H,3H-benzo[f]azepine-4-carbonitrile(CAS 105895-94-1)是一种化学化合物,分子式为C18H16N2O3S,分子量为340.09 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。
5-hydroxy-1-(4-methylphenyl)sulfonyl-2,3-dihydro-1-benzazepine-4-carbonitrile
又称:TimTec1_001321, 2,3-Dihydro-5-hydroxy-1-[(4-methylphenyl)sulfonyl]-1H-1-benzazepine-4-carbonitrile, 5-Hydroxy-1-(4-methylbenzene-1-sulfonyl)-2,3-dihydro-1H-1-benzazepine-4-carbonitrile, 5-hydroxy-1-(4-methylphenyl)sulfonyl-2,3-dihydro-1-benzazepine-4-carbonitrile, 5-hydroxy-1-[(4-methylphenyl)sulfonyl]-2H,3H-benzo[f]azepine-4-carbonitrile
| 分子式 | C18H16N2O3S |
|---|---|
| 分子量 | 340.09 g/mol |
| LogP | 3.2 |
| 拓扑极性表面积 | 89.8 Ų |
| 氢键供体数 | 1 |
| 氢键受体数 | 5 |
| 可旋转键数 | 2 |
| 精确质量 | 340.08817 |
| 重原子数 | 24 |
| 复杂度 | 647.0 |
化学标识符
| CAS 编号 | 105895-94-1 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)N2CCC(=C(C3=CC=CC=C32)O)C#N |
| InChIKey | JQFVFEABZLBADO-UHFFFAOYSA-N |
产品概述
5-hydroxy-1-[(4-methylphenyl)sulfonyl]-2H,3H-benzo[f]azepine-4-carbonitrile(CAS 105895-94-1),分子式为C18H16N2O3S,分子量为340.09 g/mol。IUPAC名:5-hydroxy-1-(4-methylphenyl)sulfonyl-2,3-dihydro-1-benzazepine-4-carbonitrile。
5-hydroxy-1-[(4-methylphenyl)sulfonyl]-2H,3H-benzo[f]azepine-4-carbonitrile化学性质概览
属性洞察:5-hydroxy-1-[(4-methylphenyl)sulfonyl]-2H,3H-benzo[f]azepine-4-carbonitrile
5-hydroxy-1-[(4-methylphenyl)sulfonyl]-2H,3H-benzo[f]azepine-4-carbonitrile的XLogP值为3.2,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89.8 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,5-hydroxy-1-[(4-methylphenyl)sulfonyl]-2H,3H-benzo[f]azepine-4-carbonitrile有1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
5-hydroxy-1-[(4-methylphenyl)sulfonyl]-2H,3H-benzo[f]azepine-4-carbonitrile的CAS号是多少?
5-hydroxy-1-[(4-methylphenyl)sulfonyl]-2H,3H-benzo[f]azepine-4-carbonitrile的CAS号为105895-94-1。
5-hydroxy-1-[(4-methylphenyl)sulfonyl]-2H,3H-benzo[f]azepine-4-carbonitrile的分子式是什么?
5-hydroxy-1-[(4-methylphenyl)sulfonyl]-2H,3H-benzo[f]azepine-4-carbonitrile的分子式为C18H16N2O3S。
5-hydroxy-1-[(4-methylphenyl)sulfonyl]-2H,3H-benzo[f]azepine-4-carbonitrile的分子量是多少?
5-hydroxy-1-[(4-methylphenyl)sulfonyl]-2H,3H-benzo[f]azepine-4-carbonitrile的分子量为340.09 g/mol。
在哪里可以购买5-hydroxy-1-[(4-methylphenyl)sulfonyl]-2H,3H-benzo[f]azepine-4-carbonitrile?
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科弘生物是否提供5-hydroxy-1-[(4-methylphenyl)sulfonyl]-2H,3H-benzo[f]azepine-4-carbonitrile的定制合成服务?
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