methyl 6-amino-5,5,7-tricyano-8-[4-[(2-methylpropan-2-yl)oxy]phenyl]-1,3,8,8a-tetrahydroisoquinoline-2-carboxylate
概要:methyl 6-amino-5,5,7-tricyano-8-[4-[(2-methylpropan-2-yl)oxy]phenyl]-1,3,8,8a-tetrahydroisoquinoline-2-carboxylate(CAS 362482-33-5)是一种化学化合物,分子式为C24H25N5O3,分子量为431.20 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 6-amino-5,5,7-tricyano-8-[4-[(2-methylpropan-2-yl)oxy]phenyl]-1,3,8,8a-tetrahydroisoquinoline-2-carboxylate
又称:methyl 6-amino-5,5,7-tricyano-8-[4-[(2-methylpropan-2-yl)oxy]phenyl]-1,3,8,8a-tetrahydroisoquinoline-2-carboxylate, methyl 6-amino-8-(4-tert-butoxyphenyl)-5,5,7-tricyano-3,5,8,8a-tetrahydro-2(1H)-isoquinolinecarboxylate, methyl 6-amino-8-(4-(tert-butoxy)phenyl)-5,5,7-tricyano-3,5,8,8a-tetrahydroisoquinoline-2(1H)-carboxylate, methyl 6-amino-8-(4-tert-butoxyphenyl)-5,5,7-tricyano-3,5,8,8a-tetrahydroisoquinoline-2(1H)-carboxylate, METHYL 6-AMINO-8-[4-(TERT-BUTOXY)PHENYL]-5,5,7-TRICYANO-3,5,8,8A-TETRAHYDRO-2(1H)-ISOQUINOLINECARBOXYLATE
| 分子式 | C24H25N5O3 |
|---|---|
| 分子量 | 431.20 g/mol |
| LogP | 3.35564 |
| 拓扑极性表面积 | 136.16 Ų |
| 氢键供体数 | 1 |
| 氢键受体数 | 7 |
| 可旋转键数 | 2 |
| 精确质量 | 431.19574 |
| 重原子数 | 32 |
| 复杂度 | 1092.7546 |
化学标识符
| CAS 编号 | 362482-33-5 |
|---|---|
| SMILES | CC(C)(C)OC1=CC=C(C=C1)C2C3CN(CC=C3C(C(=C2C#N)N)(C#N)C#N)C(=O)OC |
产品概述
methyl 6-amino-5,5,7-tricyano-8-[4-[(2-methylpropan-2-yl)oxy]phenyl]-1,3,8,8a-tetrahydroisoquinoline-2-carboxylate(CAS 362482-33-5),分子式为C24H25N5O3,分子量为431.20 g/mol。IUPAC名:methyl 6-amino-5,5,7-tricyano-8-[4-[(2-methylpropan-2-yl)oxy]phenyl]-1,3,8,8a-tetrahydroisoquinoline-2-carboxylate。
methyl 6-amino-5,5,7-tricyano-8-[4-[(2-methylpropan-2-yl)oxy]phenyl]-1,3,8,8a-tetrahydroisoquinoline-2-carboxylate化学性质概览
属性洞察:methyl 6-amino-5,5,7-tricyano-8-[4-[(2-methylpropan-2-yl)oxy]phenyl]-1,3,8,8a-tetrahydroisoquinoline-2-carboxylate
methyl 6-amino-5,5,7-tricyano-8-[4-[(2-methylpropan-2-yl)oxy]phenyl]-1,3,8,8a-tetrahydroisoquinoline-2-carboxylate的XLogP值为3.35564,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136.16 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,methyl 6-amino-5,5,7-tricyano-8-[4-[(2-methylpropan-2-yl)oxy]phenyl]-1,3,8,8a-tetrahydroisoquinoline-2-carboxylate有1个氢键供体和7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 6-amino-5,5,7-tricyano-8-[4-[(2-methylpropan-2-yl)oxy]phenyl]-1,3,8,8a-tetrahydroisoquinoline-2-carboxylate的CAS号是多少?
methyl 6-amino-5,5,7-tricyano-8-[4-[(2-methylpropan-2-yl)oxy]phenyl]-1,3,8,8a-tetrahydroisoquinoline-2-carboxylate的CAS号为362482-33-5。
methyl 6-amino-5,5,7-tricyano-8-[4-[(2-methylpropan-2-yl)oxy]phenyl]-1,3,8,8a-tetrahydroisoquinoline-2-carboxylate的分子式是什么?
methyl 6-amino-5,5,7-tricyano-8-[4-[(2-methylpropan-2-yl)oxy]phenyl]-1,3,8,8a-tetrahydroisoquinoline-2-carboxylate的分子式为C24H25N5O3。
methyl 6-amino-5,5,7-tricyano-8-[4-[(2-methylpropan-2-yl)oxy]phenyl]-1,3,8,8a-tetrahydroisoquinoline-2-carboxylate的分子量是多少?
methyl 6-amino-5,5,7-tricyano-8-[4-[(2-methylpropan-2-yl)oxy]phenyl]-1,3,8,8a-tetrahydroisoquinoline-2-carboxylate的分子量为431.20 g/mol。
在哪里可以购买methyl 6-amino-5,5,7-tricyano-8-[4-[(2-methylpropan-2-yl)oxy]phenyl]-1,3,8,8a-tetrahydroisoquinoline-2-carboxylate?
您可以直接向科弘生物询价methyl 6-amino-5,5,7-tricyano-8-[4-[(2-methylpropan-2-yl)oxy]phenyl]-1,3,8,8a-tetrahydroisoquinoline-2-carboxylate。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 6-amino-5,5,7-tricyano-8-[4-[(2-methylpropan-2-yl)oxy]phenyl]-1,3,8,8a-tetrahydroisoquinoline-2-carboxylate的定制合成服务?
是的,科弘生物提供methyl 6-amino-5,5,7-tricyano-8-[4-[(2-methylpropan-2-yl)oxy]phenyl]-1,3,8,8a-tetrahydroisoquinoline-2-carboxylate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。