2-methyl-4-[(2-phenyl(1,3-dioxolan-2-yl))methylthio]-5-hydropyridino[1,2-a]ben zimidazolecarbonitrile
概要:2-methyl-4-[(2-phenyl(1,3-dioxolan-2-yl))methylthio]-5-hydropyridino[1,2-a]ben zimidazolecarbonitrile(CAS 861634-50-6)是一种化学化合物,分子式为C23H19N3O2S,分子量为401.12 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-methyl-1-[(2-phenyl-1,3-dioxolan-2-yl)methylsulfanyl]pyrido[1,2-a]benzimidazole-4-carbonitrile
又称:2-methyl-4-[(2-phenyl(1,3-dioxolan-2-yl))methylthio]-5-hydropyridino[1,2-a]ben zimidazolecarbonitrile, 3-methyl-1-(((2-phenyl-1,3-dioxolan-2-yl)methyl)thio)benzo[4,5]imidazo[1,2-a]pyridine-4-carbonitrile, 3-methyl-1-[(2-phenyl-1,3-dioxolan-2-yl)methylsulfanyl]pyrido[1,2-a]benzimidazole-4-carbonitrile, 3-methyl-1-{[(2-phenyl-1,3-dioxolan-2-yl)methyl]sulfanyl}pyrido[1,2-a]benzimidazole-4-carbonitrile
| 分子式 | C23H19N3O2S |
|---|---|
| 分子量 | 401.12 g/mol |
| LogP | 4.6595 |
| 拓扑极性表面积 | 59.55 Ų |
| 氢键供体数 | 0 |
| 氢键受体数 | 5 |
| 可旋转键数 | 4 |
| 精确质量 | 401.1198 |
| 重原子数 | 29 |
| 复杂度 | 1237.9364 |
化学标识符
| CAS 编号 | 861634-50-6 |
|---|---|
| SMILES | CC1=C(C2=NC3=CC=CC=C3N2C(=C1)SCC4(OCCO4)C5=CC=CC=C5)C#N |
产品概述
2-methyl-4-[(2-phenyl(1,3-dioxolan-2-yl))methylthio]-5-hydropyridino[1,2-a]ben zimidazolecarbonitrile(CAS 861634-50-6),分子式为C23H19N3O2S,分子量为401.12 g/mol。IUPAC名:3-methyl-1-[(2-phenyl-1,3-dioxolan-2-yl)methylsulfanyl]pyrido[1,2-a]benzimidazole-4-carbonitrile。
2-methyl-4-[(2-phenyl(1,3-dioxolan-2-yl))methylthio]-5-hydropyridino[1,2-a]ben zimidazolecarbonitrile化学性质概览
属性洞察:2-methyl-4-[(2-phenyl(1,3-dioxolan-2-yl))methylthio]-5-hydropyridino[1,2-a]ben zimidazolecarbonitrile
2-methyl-4-[(2-phenyl(1,3-dioxolan-2-yl))methylthio]-5-hydropyridino[1,2-a]ben zimidazolecarbonitrile的XLogP值为4.6595,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。 2-methyl-4-[(2-phenyl(1,3-dioxolan-2-yl))methylthio]-5-hydropyridino[1,2-a]ben zimidazolecarbonitrile的拓扑极性表面积(TPSA)为59.55 Ų,极性较低,可能具有较好的细胞膜透过性。 根据Lipinski五规则,2-methyl-4-[(2-phenyl(1,3-dioxolan-2-yl))methylthio]-5-hydropyridino[1,2-a]ben zimidazolecarbonitrile有0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-4-[(2-phenyl(1,3-dioxolan-2-yl))methylthio]-5-hydropyridino[1,2-a]ben zimidazolecarbonitrile的CAS号是多少?
2-methyl-4-[(2-phenyl(1,3-dioxolan-2-yl))methylthio]-5-hydropyridino[1,2-a]ben zimidazolecarbonitrile的CAS号为861634-50-6。
2-methyl-4-[(2-phenyl(1,3-dioxolan-2-yl))methylthio]-5-hydropyridino[1,2-a]ben zimidazolecarbonitrile的分子式是什么?
2-methyl-4-[(2-phenyl(1,3-dioxolan-2-yl))methylthio]-5-hydropyridino[1,2-a]ben zimidazolecarbonitrile的分子式为C23H19N3O2S。
2-methyl-4-[(2-phenyl(1,3-dioxolan-2-yl))methylthio]-5-hydropyridino[1,2-a]ben zimidazolecarbonitrile的分子量是多少?
2-methyl-4-[(2-phenyl(1,3-dioxolan-2-yl))methylthio]-5-hydropyridino[1,2-a]ben zimidazolecarbonitrile的分子量为401.12 g/mol。
在哪里可以购买2-methyl-4-[(2-phenyl(1,3-dioxolan-2-yl))methylthio]-5-hydropyridino[1,2-a]ben zimidazolecarbonitrile?
您可以直接向科弘生物询价2-methyl-4-[(2-phenyl(1,3-dioxolan-2-yl))methylthio]-5-hydropyridino[1,2-a]ben zimidazolecarbonitrile。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2-methyl-4-[(2-phenyl(1,3-dioxolan-2-yl))methylthio]-5-hydropyridino[1,2-a]ben zimidazolecarbonitrile的定制合成服务?
是的,科弘生物提供2-methyl-4-[(2-phenyl(1,3-dioxolan-2-yl))methylthio]-5-hydropyridino[1,2-a]ben zimidazolecarbonitrile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。