(5Z)-1-[2-(cyclohex-1-en-1-yl)ethyl]-2-sulfanyl-5-(2,3,6,7-tetrahydro-1H,5H-pyrido[3,2,1-ij]quinolin-9-ylmethylidene)pyrimidine-4,6(1H,5H)-dione
概要:(5Z)-1-[2-(cyclohex-1-en-1-yl)ethyl]-2-sulfanyl-5-(2,3,6,7-tetrahydro-1H,5H-pyrido[3,2,1-ij]quinolin-9-ylmethylidene)pyrimidine-4,6(1H,5H)-dione(CAS 371221-58-8)是一种化学化合物,分子式为C25H29N3O2S,分子量为435.20 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。
(5Z)-5-(1-azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-trien-7-ylmethylidene)-1-[2-(cyclohexen-1-yl)ethyl]-2-sulfanylidene-1,3-diazinane-4,6-dione
又称:(5Z)-1-[2-(cyclohex-1-en-1-yl)ethyl]-2-sulfanyl-5-(2,3,6,7-tetrahydro-1H,5H-pyrido[3,2,1-ij]quinolin-9-ylmethylidene)pyrimidine-4,6(1H,5H)-dione, (5Z)-1-[2-(cyclohex-1-en-1-yl)ethyl]-5-(2,3,6,7-tetrahydro-1H,5H-pyrido[3,2,1-ij]quinolin-9-ylmethylidene)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione, (Z)-1-(2-(cyclohex-1-en-1-yl)ethyl)-5-((1,2,3,5,6,7-hexahydropyrido[3,2,1-ij]quinolin-9-yl)methylene)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione, 1-[2-(1-cyclohexen-1-yl)ethyl]-5-(2,3,6,7-tetrahydro-1H,5H-pyrido[3,2,1-ij]quinolin-9-ylmethylene)-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione
| 分子式 | C25H29N3O2S |
|---|---|
| 分子量 | 435.20 g/mol |
| LogP | 3.9026 |
| 拓扑极性表面积 | 52.65 Ų |
| 氢键供体数 | 1 |
| 氢键受体数 | 4 |
| 可旋转键数 | 4 |
| 精确质量 | 435.19806 |
| 重原子数 | 31 |
| 复杂度 | 979.01465 |
化学标识符
| CAS 编号 | 371221-58-8 |
|---|---|
| SMILES | C1CCC(=CC1)CCN2C(=O)/C(=C\C3=CC4=C5C(=C3)CCCN5CCC4)/C(=O)NC2=S |
产品概述
(5Z)-1-[2-(cyclohex-1-en-1-yl)ethyl]-2-sulfanyl-5-(2,3,6,7-tetrahydro-1H,5H-pyrido[3,2,1-ij]quinolin-9-ylmethylidene)pyrimidine-4,6(1H,5H)-dione(CAS 371221-58-8),分子式为C25H29N3O2S,分子量为435.20 g/mol。IUPAC名:(5Z)-5-(1-azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-trien-7-ylmethylidene)-1-[2-(cyclohexen-1-yl)ethyl]-2-sulfanylidene-1,3-diazinane-4,6-dione。
(5Z)-1-[2-(cyclohex-1-en-1-yl)ethyl]-2-sulfanyl-5-(2,3,6,7-tetrahydro-1H,5H-pyrido[3,2,1-ij]quinolin-9-ylmethylidene)pyrimidine-4,6(1H,5H)-dione化学性质概览
属性洞察:(5Z)-1-[2-(cyclohex-1-en-1-yl)ethyl]-2-sulfanyl-5-(2,3,6,7-tetrahydro-1H,5H-pyrido[3,2,1-ij]quinolin-9-ylmethylidene)pyrimidine-4,6(1H,5H)-dione
(5Z)-1-[2-(cyclohex-1-en-1-yl)ethyl]-2-sulfanyl-5-(2,3,6,7-tetrahydro-1H,5H-pyrido[3,2,1-ij]quinolin-9-ylmethylidene)pyrimidine-4,6(1H,5H)-dione的XLogP值为3.9026,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。 (5Z)-1-[2-(cyclohex-1-en-1-yl)ethyl]-2-sulfanyl-5-(2,3,6,7-tetrahydro-1H,5H-pyrido[3,2,1-ij]quinolin-9-ylmethylidene)pyrimidine-4,6(1H,5H)-dione的拓扑极性表面积(TPSA)为52.65 Ų,极性较低,可能具有较好的细胞膜透过性。 根据Lipinski五规则,(5Z)-1-[2-(cyclohex-1-en-1-yl)ethyl]-2-sulfanyl-5-(2,3,6,7-tetrahydro-1H,5H-pyrido[3,2,1-ij]quinolin-9-ylmethylidene)pyrimidine-4,6(1H,5H)-dione有1个氢键供体和4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
(5Z)-1-[2-(cyclohex-1-en-1-yl)ethyl]-2-sulfanyl-5-(2,3,6,7-tetrahydro-1H,5H-pyrido[3,2,1-ij]quinolin-9-ylmethylidene)pyrimidine-4,6(1H,5H)-dione的CAS号是多少?
(5Z)-1-[2-(cyclohex-1-en-1-yl)ethyl]-2-sulfanyl-5-(2,3,6,7-tetrahydro-1H,5H-pyrido[3,2,1-ij]quinolin-9-ylmethylidene)pyrimidine-4,6(1H,5H)-dione的CAS号为371221-58-8。
(5Z)-1-[2-(cyclohex-1-en-1-yl)ethyl]-2-sulfanyl-5-(2,3,6,7-tetrahydro-1H,5H-pyrido[3,2,1-ij]quinolin-9-ylmethylidene)pyrimidine-4,6(1H,5H)-dione的分子式是什么?
(5Z)-1-[2-(cyclohex-1-en-1-yl)ethyl]-2-sulfanyl-5-(2,3,6,7-tetrahydro-1H,5H-pyrido[3,2,1-ij]quinolin-9-ylmethylidene)pyrimidine-4,6(1H,5H)-dione的分子式为C25H29N3O2S。
(5Z)-1-[2-(cyclohex-1-en-1-yl)ethyl]-2-sulfanyl-5-(2,3,6,7-tetrahydro-1H,5H-pyrido[3,2,1-ij]quinolin-9-ylmethylidene)pyrimidine-4,6(1H,5H)-dione的分子量是多少?
(5Z)-1-[2-(cyclohex-1-en-1-yl)ethyl]-2-sulfanyl-5-(2,3,6,7-tetrahydro-1H,5H-pyrido[3,2,1-ij]quinolin-9-ylmethylidene)pyrimidine-4,6(1H,5H)-dione的分子量为435.20 g/mol。
在哪里可以购买(5Z)-1-[2-(cyclohex-1-en-1-yl)ethyl]-2-sulfanyl-5-(2,3,6,7-tetrahydro-1H,5H-pyrido[3,2,1-ij]quinolin-9-ylmethylidene)pyrimidine-4,6(1H,5H)-dione?
您可以直接向科弘生物询价(5Z)-1-[2-(cyclohex-1-en-1-yl)ethyl]-2-sulfanyl-5-(2,3,6,7-tetrahydro-1H,5H-pyrido[3,2,1-ij]quinolin-9-ylmethylidene)pyrimidine-4,6(1H,5H)-dione。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(5Z)-1-[2-(cyclohex-1-en-1-yl)ethyl]-2-sulfanyl-5-(2,3,6,7-tetrahydro-1H,5H-pyrido[3,2,1-ij]quinolin-9-ylmethylidene)pyrimidine-4,6(1H,5H)-dione的定制合成服务?
是的,科弘生物提供(5Z)-1-[2-(cyclohex-1-en-1-yl)ethyl]-2-sulfanyl-5-(2,3,6,7-tetrahydro-1H,5H-pyrido[3,2,1-ij]quinolin-9-ylmethylidene)pyrimidine-4,6(1H,5H)-dione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。