(3aR,4S,9aR,9bS)-2-(naphthalen-2-yl)-1,3-dioxo-4-(phenylcarbonyl)-2,3,3a,4,9a,9b-hexahydro-1H-pyrrolo[3,4-a]indolizine-8-carbonitrile
概要:(3aR,4S,9aR,9bS)-2-(naphthalen-2-yl)-1,3-dioxo-4-(phenylcarbonyl)-2,3,3a,4,9a,9b-hexahydro-1H-pyrrolo[3,4-a]indolizine-8-carbonitrile(CAS 1013824-09-3)是一种化学化合物,分子式为C28H19N3O3,分子量为445.14 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。
(3aR,4S,9aR,9bS)-4-benzoyl-2-naphthalen-2-yl-1,3-dioxo-3a,4,9a,9b-tetrahydropyrrolo[3,4-a]indolizine-8-carbonitrile
又称:(3aR,4S,9aR,9bS)-2-(naphthalen-2-yl)-1,3-dioxo-4-(phenylcarbonyl)-2,3,3a,4,9a,9b-hexahydro-1H-pyrrolo[3,4-a]indolizine-8-carbonitrile, (3aR,4S,9aR,9bS)-4-benzoyl-2-(naphthalen-2-yl)-1,3-dioxo-2,3,3a,4,9a,9b-hexahydro-1H-pyrrolo[3,4-a]indolizine-8-carbonitrile, (3aR,4S,9aR,9bS)-4-benzoyl-2-naphthalen-2-yl-1,3-dioxo-3a,4,9a,9b-tetrahydropyrrolo[3,4-a]indolizine-8-carbonitrile
| 分子式 | C28H19N3O3 |
|---|---|
| 分子量 | 445.14 g/mol |
| LogP | 3.85838 |
| 拓扑极性表面积 | 81.48 Ų |
| 氢键供体数 | 0 |
| 氢键受体数 | 5 |
| 可旋转键数 | 3 |
| 精确质量 | 445.14264 |
| 重原子数 | 34 |
| 复杂度 | 1466.9995 |
化学标识符
| CAS 编号 | 1013824-09-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)[C@@H]2[C@H]3[C@@H]([C@@H]4N2C=CC(=C4)C#N)C(=O)N(C3=O)C5=CC6=CC=CC=C6C=C5 |
产品概述
(3aR,4S,9aR,9bS)-2-(naphthalen-2-yl)-1,3-dioxo-4-(phenylcarbonyl)-2,3,3a,4,9a,9b-hexahydro-1H-pyrrolo[3,4-a]indolizine-8-carbonitrile(CAS 1013824-09-3),分子式为C28H19N3O3,分子量为445.14 g/mol。IUPAC名:(3aR,4S,9aR,9bS)-4-benzoyl-2-naphthalen-2-yl-1,3-dioxo-3a,4,9a,9b-tetrahydropyrrolo[3,4-a]indolizine-8-carbonitrile。
(3aR,4S,9aR,9bS)-2-(naphthalen-2-yl)-1,3-dioxo-4-(phenylcarbonyl)-2,3,3a,4,9a,9b-hexahydro-1H-pyrrolo[3,4-a]indolizine-8-carbonitrile化学性质概览
属性洞察:(3aR,4S,9aR,9bS)-2-(naphthalen-2-yl)-1,3-dioxo-4-(phenylcarbonyl)-2,3,3a,4,9a,9b-hexahydro-1H-pyrrolo[3,4-a]indolizine-8-carbonitrile
(3aR,4S,9aR,9bS)-2-(naphthalen-2-yl)-1,3-dioxo-4-(phenylcarbonyl)-2,3,3a,4,9a,9b-hexahydro-1H-pyrrolo[3,4-a]indolizine-8-carbonitrile的XLogP值为3.85838,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81.48 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,(3aR,4S,9aR,9bS)-2-(naphthalen-2-yl)-1,3-dioxo-4-(phenylcarbonyl)-2,3,3a,4,9a,9b-hexahydro-1H-pyrrolo[3,4-a]indolizine-8-carbonitrile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
(3aR,4S,9aR,9bS)-2-(naphthalen-2-yl)-1,3-dioxo-4-(phenylcarbonyl)-2,3,3a,4,9a,9b-hexahydro-1H-pyrrolo[3,4-a]indolizine-8-carbonitrile的CAS号是多少?
(3aR,4S,9aR,9bS)-2-(naphthalen-2-yl)-1,3-dioxo-4-(phenylcarbonyl)-2,3,3a,4,9a,9b-hexahydro-1H-pyrrolo[3,4-a]indolizine-8-carbonitrile的CAS号为1013824-09-3。
(3aR,4S,9aR,9bS)-2-(naphthalen-2-yl)-1,3-dioxo-4-(phenylcarbonyl)-2,3,3a,4,9a,9b-hexahydro-1H-pyrrolo[3,4-a]indolizine-8-carbonitrile的分子式是什么?
(3aR,4S,9aR,9bS)-2-(naphthalen-2-yl)-1,3-dioxo-4-(phenylcarbonyl)-2,3,3a,4,9a,9b-hexahydro-1H-pyrrolo[3,4-a]indolizine-8-carbonitrile的分子式为C28H19N3O3。
(3aR,4S,9aR,9bS)-2-(naphthalen-2-yl)-1,3-dioxo-4-(phenylcarbonyl)-2,3,3a,4,9a,9b-hexahydro-1H-pyrrolo[3,4-a]indolizine-8-carbonitrile的分子量是多少?
(3aR,4S,9aR,9bS)-2-(naphthalen-2-yl)-1,3-dioxo-4-(phenylcarbonyl)-2,3,3a,4,9a,9b-hexahydro-1H-pyrrolo[3,4-a]indolizine-8-carbonitrile的分子量为445.14 g/mol。
在哪里可以购买(3aR,4S,9aR,9bS)-2-(naphthalen-2-yl)-1,3-dioxo-4-(phenylcarbonyl)-2,3,3a,4,9a,9b-hexahydro-1H-pyrrolo[3,4-a]indolizine-8-carbonitrile?
您可以直接向科弘生物询价(3aR,4S,9aR,9bS)-2-(naphthalen-2-yl)-1,3-dioxo-4-(phenylcarbonyl)-2,3,3a,4,9a,9b-hexahydro-1H-pyrrolo[3,4-a]indolizine-8-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(3aR,4S,9aR,9bS)-2-(naphthalen-2-yl)-1,3-dioxo-4-(phenylcarbonyl)-2,3,3a,4,9a,9b-hexahydro-1H-pyrrolo[3,4-a]indolizine-8-carbonitrile的定制合成服务?
是的,科弘生物提供(3aR,4S,9aR,9bS)-2-(naphthalen-2-yl)-1,3-dioxo-4-(phenylcarbonyl)-2,3,3a,4,9a,9b-hexahydro-1H-pyrrolo[3,4-a]indolizine-8-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。