2-((4-allyl-5-(thiophen-2-ylmethyl)-4H-1,2,4-triazol-3-yl)thio)-N-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)acetamide
概要:2-((4-allyl-5-(thiophen-2-ylmethyl)-4H-1,2,4-triazol-3-yl)thio)-N-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)acetamide(CAS 852404-68-3)是一种化学化合物,分子式为C20H20N4O3S2,分子量为428.10 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。
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[[4-prop-2-enyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide
又称:2-((4-allyl-5-(thiophen-2-ylmethyl)-4H-1,2,4-triazol-3-yl)thio)-N-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)acetamide, N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[[4-prop-2-enyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide, N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-{[4-(prop-2-en-1-yl)-5-(thiophen-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
| 分子式 | C20H20N4O3S2 |
|---|---|
| 分子量 | 428.10 g/mol |
| LogP | 3.6184 |
| 拓扑极性表面积 | 78.27 Ų |
| 氢键供体数 | 1 |
| 氢键受体数 | 7 |
| 可旋转键数 | 8 |
| 精确质量 | 428.0977 |
| 重原子数 | 29 |
| 复杂度 | 1001.3324 |
化学标识符
| CAS 编号 | 852404-68-3 |
|---|---|
| SMILES | C=CCN1C(=NN=C1SCC(=O)NC2=CC3=C(C=C2)OCCO3)CC4=CC=CS4 |
产品概述
2-((4-allyl-5-(thiophen-2-ylmethyl)-4H-1,2,4-triazol-3-yl)thio)-N-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)acetamide(CAS 852404-68-3),分子式为C20H20N4O3S2,分子量为428.10 g/mol。IUPAC名:N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[[4-prop-2-enyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide。
2-((4-allyl-5-(thiophen-2-ylmethyl)-4H-1,2,4-triazol-3-yl)thio)-N-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)acetamide化学性质概览
属性洞察:2-((4-allyl-5-(thiophen-2-ylmethyl)-4H-1,2,4-triazol-3-yl)thio)-N-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)acetamide
2-((4-allyl-5-(thiophen-2-ylmethyl)-4H-1,2,4-triazol-3-yl)thio)-N-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)acetamide的XLogP值为3.6184,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78.27 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,2-((4-allyl-5-(thiophen-2-ylmethyl)-4H-1,2,4-triazol-3-yl)thio)-N-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)acetamide有1个氢键供体和7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
2-((4-allyl-5-(thiophen-2-ylmethyl)-4H-1,2,4-triazol-3-yl)thio)-N-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)acetamide的CAS号是多少?
2-((4-allyl-5-(thiophen-2-ylmethyl)-4H-1,2,4-triazol-3-yl)thio)-N-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)acetamide的CAS号为852404-68-3。
2-((4-allyl-5-(thiophen-2-ylmethyl)-4H-1,2,4-triazol-3-yl)thio)-N-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)acetamide的分子式是什么?
2-((4-allyl-5-(thiophen-2-ylmethyl)-4H-1,2,4-triazol-3-yl)thio)-N-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)acetamide的分子式为C20H20N4O3S2。
2-((4-allyl-5-(thiophen-2-ylmethyl)-4H-1,2,4-triazol-3-yl)thio)-N-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)acetamide的分子量是多少?
2-((4-allyl-5-(thiophen-2-ylmethyl)-4H-1,2,4-triazol-3-yl)thio)-N-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)acetamide的分子量为428.10 g/mol。
在哪里可以购买2-((4-allyl-5-(thiophen-2-ylmethyl)-4H-1,2,4-triazol-3-yl)thio)-N-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)acetamide?
您可以直接向科弘生物询价2-((4-allyl-5-(thiophen-2-ylmethyl)-4H-1,2,4-triazol-3-yl)thio)-N-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)acetamide。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2-((4-allyl-5-(thiophen-2-ylmethyl)-4H-1,2,4-triazol-3-yl)thio)-N-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)acetamide的定制合成服务?
是的,科弘生物提供2-((4-allyl-5-(thiophen-2-ylmethyl)-4H-1,2,4-triazol-3-yl)thio)-N-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)acetamide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。