2-[(4-chlorobenzyl)sulfanyl]-4-(4-methoxyphenyl)-7,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
概要:2-[(4-chlorobenzyl)sulfanyl]-4-(4-methoxyphenyl)-7,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile(CAS 370854-37-8)是一种化学化合物,分子式为C26H25ClN2O2S,分子量为464.13 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-[(4-chlorophenyl)methylsulfanyl]-4-(4-methoxyphenyl)-7,7-dimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carbonitrile
又称:2-[(4-chlorobenzyl)sulfanyl]-4-(4-methoxyphenyl)-7,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile, 2-((4-chlorobenzyl)thio)-4-(4-methoxyphenyl)-7,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile, 2-[(4-chlorobenzyl)sulfanyl]-5-hydroxy-4-(4-methoxyphenyl)-7,7-dimethyl-4,6,7,8-tetrahydroquinoline-3-carbonitrile, 2-[(4-chlorophenyl)methylsulfanyl]-4-(4-methoxyphenyl)-7,7-dimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carbonitrile
| 分子式 | C26H25ClN2O2S |
|---|---|
| 分子量 | 464.13 g/mol |
| LogP | 6.34718 |
| 拓扑极性表面积 | 62.12 Ų |
| 氢键供体数 | 1 |
| 氢键受体数 | 5 |
| 可旋转键数 | 5 |
| 精确质量 | 464.13254 |
| 重原子数 | 32 |
| 复杂度 | 1141.8445 |
化学标识符
| CAS 编号 | 370854-37-8 |
|---|---|
| SMILES | CC1(CC2=C(C(C(=C(N2)SCC3=CC=C(C=C3)Cl)C#N)C4=CC=C(C=C4)OC)C(=O)C1)C |
产品概述
2-[(4-chlorobenzyl)sulfanyl]-4-(4-methoxyphenyl)-7,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile(CAS 370854-37-8),分子式为C26H25ClN2O2S,分子量为464.13 g/mol。IUPAC名:2-[(4-chlorophenyl)methylsulfanyl]-4-(4-methoxyphenyl)-7,7-dimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carbonitrile。
2-[(4-chlorobenzyl)sulfanyl]-4-(4-methoxyphenyl)-7,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile化学性质概览
属性洞察:2-[(4-chlorobenzyl)sulfanyl]-4-(4-methoxyphenyl)-7,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
2-[(4-chlorobenzyl)sulfanyl]-4-(4-methoxyphenyl)-7,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile的XLogP值为6.34718,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62.12 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-[(4-chlorobenzyl)sulfanyl]-4-(4-methoxyphenyl)-7,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile有1个氢键供体和5个氢键受体,可能需要考虑配方优化。
常见问题
常见问题
2-[(4-chlorobenzyl)sulfanyl]-4-(4-methoxyphenyl)-7,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile的CAS号是多少?
2-[(4-chlorobenzyl)sulfanyl]-4-(4-methoxyphenyl)-7,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile的CAS号为370854-37-8。
2-[(4-chlorobenzyl)sulfanyl]-4-(4-methoxyphenyl)-7,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile的分子式是什么?
2-[(4-chlorobenzyl)sulfanyl]-4-(4-methoxyphenyl)-7,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile的分子式为C26H25ClN2O2S。
2-[(4-chlorobenzyl)sulfanyl]-4-(4-methoxyphenyl)-7,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile的分子量是多少?
2-[(4-chlorobenzyl)sulfanyl]-4-(4-methoxyphenyl)-7,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile的分子量为464.13 g/mol。
在哪里可以购买2-[(4-chlorobenzyl)sulfanyl]-4-(4-methoxyphenyl)-7,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile?
您可以直接向科弘生物询价2-[(4-chlorobenzyl)sulfanyl]-4-(4-methoxyphenyl)-7,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile。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-[(4-chlorobenzyl)sulfanyl]-4-(4-methoxyphenyl)-7,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile的定制合成服务?
是的,科弘生物提供2-[(4-chlorobenzyl)sulfanyl]-4-(4-methoxyphenyl)-7,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile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。