3-[3-(1H-imidazol-1-yl)propyl]-4-imino-5-(4-methoxyphenyl)-8,8-dimethyl-3,4,5,7,8,9-hexahydro-6H-chromeno[2,3-d]pyrimidin-6-one
概要:3-[3-(1H-imidazol-1-yl)propyl]-4-imino-5-(4-methoxyphenyl)-8,8-dimethyl-3,4,5,7,8,9-hexahydro-6H-chromeno[2,3-d]pyrimidin-6-one(CAS 848220-34-8)是一种化学化合物,分子式为C26H29N5O3,分子量为459.23 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-(3-imidazol-1-ylpropyl)-4-imino-5-(4-methoxyphenyl)-8,8-dimethyl-7,9-dihydro-5H-chromeno[2,3-d]pyrimidin-6-one
又称:3-[3-(1H-imidazol-1-yl)propyl]-4-imino-5-(4-methoxyphenyl)-8,8-dimethyl-3,4,5,7,8,9-hexahydro-6H-chromeno[2,3-d]pyrimidin-6-one, 3-(3-(1H-imidazol-1-yl)propyl)-4-imino-5-(4-methoxyphenyl)-8,8-dimethyl-5,7,8,9-tetrahydro-3H-chromeno[2,3-d]pyrimidin-6(4H)-one, 3-(3-imidazol-1-ylpropyl)-4-imino-5-(4-methoxyphenyl)-8,8-dimethyl-7,9-dihydro-5H-chromeno[2,3-d]pyrimidin-6-one
| 分子式 | C26H29N5O3 |
|---|---|
| 分子量 | 459.23 g/mol |
| LogP | 2.3 |
| 拓扑极性表面积 | 92.8 Ų |
| 氢键供体数 | 1 |
| 氢键受体数 | 6 |
| 可旋转键数 | 6 |
| 精确质量 | 459.22705 |
| 重原子数 | 34 |
| 复杂度 | 929.0 |
化学标识符
| CAS 编号 | 848220-34-8 |
|---|---|
| SMILES | CC1(CC2=C(C(C3=C(O2)N=CN(C3=N)CCCN4C=CN=C4)C5=CC=C(C=C5)OC)C(=O)C1)C |
| InChIKey | VQTZGMNKFIGIAX-UHFFFAOYSA-N |
产品概述
3-[3-(1H-imidazol-1-yl)propyl]-4-imino-5-(4-methoxyphenyl)-8,8-dimethyl-3,4,5,7,8,9-hexahydro-6H-chromeno[2,3-d]pyrimidin-6-one(CAS 848220-34-8),分子式为C26H29N5O3,分子量为459.23 g/mol。IUPAC名:3-(3-imidazol-1-ylpropyl)-4-imino-5-(4-methoxyphenyl)-8,8-dimethyl-7,9-dihydro-5H-chromeno[2,3-d]pyrimidin-6-one。
3-[3-(1H-imidazol-1-yl)propyl]-4-imino-5-(4-methoxyphenyl)-8,8-dimethyl-3,4,5,7,8,9-hexahydro-6H-chromeno[2,3-d]pyrimidin-6-one化学性质概览
属性洞察:3-[3-(1H-imidazol-1-yl)propyl]-4-imino-5-(4-methoxyphenyl)-8,8-dimethyl-3,4,5,7,8,9-hexahydro-6H-chromeno[2,3-d]pyrimidin-6-one
3-[3-(1H-imidazol-1-yl)propyl]-4-imino-5-(4-methoxyphenyl)-8,8-dimethyl-3,4,5,7,8,9-hexahydro-6H-chromeno[2,3-d]pyrimidin-6-one的XLogP值为2.3,表明具有中等亲脂性,在水溶性和膜透过性之间取得平衡。 TPSA为92.8 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,3-[3-(1H-imidazol-1-yl)propyl]-4-imino-5-(4-methoxyphenyl)-8,8-dimethyl-3,4,5,7,8,9-hexahydro-6H-chromeno[2,3-d]pyrimidin-6-one有1个氢键供体和6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
3-[3-(1H-imidazol-1-yl)propyl]-4-imino-5-(4-methoxyphenyl)-8,8-dimethyl-3,4,5,7,8,9-hexahydro-6H-chromeno[2,3-d]pyrimidin-6-one的CAS号是多少?
3-[3-(1H-imidazol-1-yl)propyl]-4-imino-5-(4-methoxyphenyl)-8,8-dimethyl-3,4,5,7,8,9-hexahydro-6H-chromeno[2,3-d]pyrimidin-6-one的CAS号为848220-34-8。
3-[3-(1H-imidazol-1-yl)propyl]-4-imino-5-(4-methoxyphenyl)-8,8-dimethyl-3,4,5,7,8,9-hexahydro-6H-chromeno[2,3-d]pyrimidin-6-one的分子式是什么?
3-[3-(1H-imidazol-1-yl)propyl]-4-imino-5-(4-methoxyphenyl)-8,8-dimethyl-3,4,5,7,8,9-hexahydro-6H-chromeno[2,3-d]pyrimidin-6-one的分子式为C26H29N5O3。
3-[3-(1H-imidazol-1-yl)propyl]-4-imino-5-(4-methoxyphenyl)-8,8-dimethyl-3,4,5,7,8,9-hexahydro-6H-chromeno[2,3-d]pyrimidin-6-one的分子量是多少?
3-[3-(1H-imidazol-1-yl)propyl]-4-imino-5-(4-methoxyphenyl)-8,8-dimethyl-3,4,5,7,8,9-hexahydro-6H-chromeno[2,3-d]pyrimidin-6-one的分子量为459.23 g/mol。
在哪里可以购买3-[3-(1H-imidazol-1-yl)propyl]-4-imino-5-(4-methoxyphenyl)-8,8-dimethyl-3,4,5,7,8,9-hexahydro-6H-chromeno[2,3-d]pyrimidin-6-one?
您可以直接向科弘生物询价3-[3-(1H-imidazol-1-yl)propyl]-4-imino-5-(4-methoxyphenyl)-8,8-dimethyl-3,4,5,7,8,9-hexahydro-6H-chromeno[2,3-d]pyrimidin-6-one。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3-[3-(1H-imidazol-1-yl)propyl]-4-imino-5-(4-methoxyphenyl)-8,8-dimethyl-3,4,5,7,8,9-hexahydro-6H-chromeno[2,3-d]pyrimidin-6-one的定制合成服务?
是的,科弘生物提供3-[3-(1H-imidazol-1-yl)propyl]-4-imino-5-(4-methoxyphenyl)-8,8-dimethyl-3,4,5,7,8,9-hexahydro-6H-chromeno[2,3-d]pyrimidin-6-one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。