(Z)-1-(2-(cyclohex-1-en-1-yl)ethyl)-5-((1-(4-fluorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl)methylene)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
概要:(Z)-1-(2-(cyclohex-1-en-1-yl)ethyl)-5-((1-(4-fluorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl)methylene)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione(CAS 573669-86-0)是一种化学化合物,分子式为C25H26FN3O2S,分子量为451.17 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)-1-[2-(cyclohexen-1-yl)ethyl]-5-[[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
又称:(Z)-1-(2-(cyclohex-1-en-1-yl)ethyl)-5-((1-(4-fluorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl)methylene)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione, (5Z)-1-[2-(cyclohex-1-en-1-yl)ethyl]-5-{[1-(4-fluorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-2-sulfanylpyrimidine-4,6(1H,5H)-dione, (5Z)-1-[2-(cyclohexen-1-yl)ethyl]-5-[[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
| 分子式 | C25H26FN3O2S |
|---|---|
| 分子量 | 451.17 g/mol |
| LogP | 4.75044 |
| 拓扑极性表面积 | 54.34 Ų |
| 氢键供体数 | 1 |
| 氢键受体数 | 3 |
| 可旋转键数 | 5 |
| 精确质量 | 451.17297 |
| 重原子数 | 32 |
| 复杂度 | 1144.682 |
化学标识符
| CAS 编号 | 573669-86-0 |
|---|---|
| SMILES | CC1=CC(=C(N1C2=CC=C(C=C2)F)C)/C=C\3/C(=O)NC(=S)N(C3=O)CCC4=CCCCC4 |
产品概述
(Z)-1-(2-(cyclohex-1-en-1-yl)ethyl)-5-((1-(4-fluorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl)methylene)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione(CAS 573669-86-0),分子式为C25H26FN3O2S,分子量为451.17 g/mol。IUPAC名:(5Z)-1-[2-(cyclohexen-1-yl)ethyl]-5-[[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione。
(Z)-1-(2-(cyclohex-1-en-1-yl)ethyl)-5-((1-(4-fluorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl)methylene)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione化学性质概览
属性洞察:(Z)-1-(2-(cyclohex-1-en-1-yl)ethyl)-5-((1-(4-fluorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl)methylene)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
(Z)-1-(2-(cyclohex-1-en-1-yl)ethyl)-5-((1-(4-fluorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl)methylene)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione的XLogP值为4.75044,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。 (Z)-1-(2-(cyclohex-1-en-1-yl)ethyl)-5-((1-(4-fluorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl)methylene)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione的拓扑极性表面积(TPSA)为54.34 Ų,极性较低,可能具有较好的细胞膜透过性。 根据Lipinski五规则,(Z)-1-(2-(cyclohex-1-en-1-yl)ethyl)-5-((1-(4-fluorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl)methylene)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione有1个氢键供体和3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
(Z)-1-(2-(cyclohex-1-en-1-yl)ethyl)-5-((1-(4-fluorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl)methylene)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione的CAS号是多少?
(Z)-1-(2-(cyclohex-1-en-1-yl)ethyl)-5-((1-(4-fluorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl)methylene)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione的CAS号为573669-86-0。
(Z)-1-(2-(cyclohex-1-en-1-yl)ethyl)-5-((1-(4-fluorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl)methylene)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione的分子式是什么?
(Z)-1-(2-(cyclohex-1-en-1-yl)ethyl)-5-((1-(4-fluorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl)methylene)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione的分子式为C25H26FN3O2S。
(Z)-1-(2-(cyclohex-1-en-1-yl)ethyl)-5-((1-(4-fluorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl)methylene)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione的分子量是多少?
(Z)-1-(2-(cyclohex-1-en-1-yl)ethyl)-5-((1-(4-fluorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl)methylene)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione的分子量为451.17 g/mol。
在哪里可以购买(Z)-1-(2-(cyclohex-1-en-1-yl)ethyl)-5-((1-(4-fluorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl)methylene)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione?
您可以直接向科弘生物询价(Z)-1-(2-(cyclohex-1-en-1-yl)ethyl)-5-((1-(4-fluorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl)methylene)-2-thioxodihydropyrimidine-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(Z)-1-(2-(cyclohex-1-en-1-yl)ethyl)-5-((1-(4-fluorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl)methylene)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione的定制合成服务?
是的,科弘生物提供(Z)-1-(2-(cyclohex-1-en-1-yl)ethyl)-5-((1-(4-fluorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl)methylene)-2-thioxodihydropyrimidine-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。