5-(benzo[d][1,3]dioxol-5-yl)-N-(thiophen-2-ylmethyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide
概要:5-(benzo[d][1,3]dioxol-5-yl)-N-(thiophen-2-ylmethyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide(CAS 833428-27-6)是一种化学化合物,分子式为C20H17F3N4O3S,分子量为450.10 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。
5-(1,3-benzodioxol-5-yl)-N-(thiophen-2-ylmethyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide
又称:5-(benzo[d][1,3]dioxol-5-yl)-N-(thiophen-2-ylmethyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide, [5-(2H-benzo[3,4-d]1,3-dioxolan-5-yl)-7-(trifluoromethyl)(4H,5H,6H,7H-pyrazolo [1,5-a]1,3-diazaperhydroin-2-yl)]-N-(2-thienylmethyl)carboxamide, 5-(1,3-benzodioxol-5-yl)-N-(thiophen-2-ylmethyl)-7-(trifluoromethyl)-1,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide, 5-(1,3-benzodioxol-5-yl)-N-(thiophen-2-ylmethyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide
| 分子式 | C20H17F3N4O3S |
|---|---|
| 分子量 | 450.10 g/mol |
| LogP | 4.2636 |
| 拓扑极性表面积 | 77.41 Ų |
| 氢键供体数 | 2 |
| 氢键受体数 | 6 |
| 可旋转键数 | 4 |
| 精确质量 | 450.09735 |
| 重原子数 | 31 |
| 复杂度 | 1113.5707 |
化学标识符
| CAS 编号 | 833428-27-6 |
|---|---|
| SMILES | C1C(NC2=CC(=NN2C1C(F)(F)F)C(=O)NCC3=CC=CS3)C4=CC5=C(C=C4)OCO5 |
产品概述
5-(benzo[d][1,3]dioxol-5-yl)-N-(thiophen-2-ylmethyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide(CAS 833428-27-6),分子式为C20H17F3N4O3S,分子量为450.10 g/mol。IUPAC名:5-(1,3-benzodioxol-5-yl)-N-(thiophen-2-ylmethyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide。
5-(benzo[d][1,3]dioxol-5-yl)-N-(thiophen-2-ylmethyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide化学性质概览
属性洞察:5-(benzo[d][1,3]dioxol-5-yl)-N-(thiophen-2-ylmethyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide
5-(benzo[d][1,3]dioxol-5-yl)-N-(thiophen-2-ylmethyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide的XLogP值为4.2636,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77.41 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,5-(benzo[d][1,3]dioxol-5-yl)-N-(thiophen-2-ylmethyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide有2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
5-(benzo[d][1,3]dioxol-5-yl)-N-(thiophen-2-ylmethyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide的CAS号是多少?
5-(benzo[d][1,3]dioxol-5-yl)-N-(thiophen-2-ylmethyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide的CAS号为833428-27-6。
5-(benzo[d][1,3]dioxol-5-yl)-N-(thiophen-2-ylmethyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide的分子式是什么?
5-(benzo[d][1,3]dioxol-5-yl)-N-(thiophen-2-ylmethyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide的分子式为C20H17F3N4O3S。
5-(benzo[d][1,3]dioxol-5-yl)-N-(thiophen-2-ylmethyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide的分子量是多少?
5-(benzo[d][1,3]dioxol-5-yl)-N-(thiophen-2-ylmethyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide的分子量为450.10 g/mol。
在哪里可以购买5-(benzo[d][1,3]dioxol-5-yl)-N-(thiophen-2-ylmethyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide?
您可以直接向科弘生物询价5-(benzo[d][1,3]dioxol-5-yl)-N-(thiophen-2-ylmethyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide。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5-(benzo[d][1,3]dioxol-5-yl)-N-(thiophen-2-ylmethyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide的定制合成服务?
是的,科弘生物提供5-(benzo[d][1,3]dioxol-5-yl)-N-(thiophen-2-ylmethyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide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。