2-((11-isobutyl-7,8,9,10-tetrahydro-[1,2,4]triazolo[4'',3'':1',6']pyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-3-yl)thio)-N-(p-tolyl)acetamide
概要:2-((11-isobutyl-7,8,9,10-tetrahydro-[1,2,4]triazolo[4'',3'':1',6']pyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-3-yl)thio)-N-(p-tolyl)acetamide(CAS 488861-52-5)是一种化学化合物,分子式为C27H28N6OS2,分子量为516.18 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-(4-methylphenyl)-2-[[14-(2-methylpropyl)-11-thia-3,5,7,8,13-pentazapentacyclo[10.8.0.02,10.05,9.015,20]icosa-1(12),2(10),3,6,8,13,15(20)-heptaen-6-yl]sulfanyl]acetamide
又称:2-((11-isobutyl-7,8,9,10-tetrahydro-[1,2,4]triazolo[4'',3'':1',6']pyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-3-yl)thio)-N-(p-tolyl)acetamide, N-(4-Methylphenyl)-2-[(11-(2-methylpropyl)-7,8,9,10-tetrahydro[1,2,4]triazolo[4'',3'':1',6']-pyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-3-yl)-sulfanyl]acetamide, N-(4-methylphenyl)-2-{[11-(2-methylpropyl)-7,8,9,10-tetrahydro[1,2,4]triazolo[4'',3'':1',6']pyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-3-yl]sulfanyl}acetamide
| 分子式 | C27H28N6OS2 |
|---|---|
| 分子量 | 516.18 g/mol |
| LogP | 6.00372 |
| 拓扑极性表面积 | 85.07 Ų |
| 氢键供体数 | 1 |
| 氢键受体数 | 7 |
| 可旋转键数 | 6 |
| 精确质量 | 516.1766 |
| 重原子数 | 36 |
| 复杂度 | 1602.4877 |
化学标识符
| CAS 编号 | 488861-52-5 |
|---|---|
| SMILES | CC1=CC=C(C=C1)NC(=O)CSC2=NN=C3N2C=NC4=C3SC5=C4C6=C(CCCC6)C(=N5)CC(C)C |
产品概述
2-((11-isobutyl-7,8,9,10-tetrahydro-[1,2,4]triazolo[4'',3'':1',6']pyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-3-yl)thio)-N-(p-tolyl)acetamide(CAS 488861-52-5),分子式为C27H28N6OS2,分子量为516.18 g/mol。IUPAC名:N-(4-methylphenyl)-2-[[14-(2-methylpropyl)-11-thia-3,5,7,8,13-pentazapentacyclo[10.8.0.02,10.05,9.015,20]icosa-1(12),2(10),3,6,8,13,15(20)-heptaen-6-yl]sulfanyl]acetamide。
2-((11-isobutyl-7,8,9,10-tetrahydro-[1,2,4]triazolo[4'',3'':1',6']pyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-3-yl)thio)-N-(p-tolyl)acetamide化学性质概览
属性洞察:2-((11-isobutyl-7,8,9,10-tetrahydro-[1,2,4]triazolo[4'',3'':1',6']pyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-3-yl)thio)-N-(p-tolyl)acetamide
2-((11-isobutyl-7,8,9,10-tetrahydro-[1,2,4]triazolo[4'',3'':1',6']pyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-3-yl)thio)-N-(p-tolyl)acetamide的XLogP值为6.00372,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85.07 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-((11-isobutyl-7,8,9,10-tetrahydro-[1,2,4]triazolo[4'',3'':1',6']pyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-3-yl)thio)-N-(p-tolyl)acetamide有1个氢键供体和7个氢键受体,可能需要考虑配方优化。
常见问题
常见问题
2-((11-isobutyl-7,8,9,10-tetrahydro-[1,2,4]triazolo[4'',3'':1',6']pyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-3-yl)thio)-N-(p-tolyl)acetamide的CAS号是多少?
2-((11-isobutyl-7,8,9,10-tetrahydro-[1,2,4]triazolo[4'',3'':1',6']pyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-3-yl)thio)-N-(p-tolyl)acetamide的CAS号为488861-52-5。
2-((11-isobutyl-7,8,9,10-tetrahydro-[1,2,4]triazolo[4'',3'':1',6']pyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-3-yl)thio)-N-(p-tolyl)acetamide的分子式是什么?
2-((11-isobutyl-7,8,9,10-tetrahydro-[1,2,4]triazolo[4'',3'':1',6']pyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-3-yl)thio)-N-(p-tolyl)acetamide的分子式为C27H28N6OS2。
2-((11-isobutyl-7,8,9,10-tetrahydro-[1,2,4]triazolo[4'',3'':1',6']pyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-3-yl)thio)-N-(p-tolyl)acetamide的分子量是多少?
2-((11-isobutyl-7,8,9,10-tetrahydro-[1,2,4]triazolo[4'',3'':1',6']pyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-3-yl)thio)-N-(p-tolyl)acetamide的分子量为516.18 g/mol。
在哪里可以购买2-((11-isobutyl-7,8,9,10-tetrahydro-[1,2,4]triazolo[4'',3'':1',6']pyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-3-yl)thio)-N-(p-tolyl)acetamide?
您可以直接向科弘生物询价2-((11-isobutyl-7,8,9,10-tetrahydro-[1,2,4]triazolo[4'',3'':1',6']pyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-3-yl)thio)-N-(p-tolyl)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-((11-isobutyl-7,8,9,10-tetrahydro-[1,2,4]triazolo[4'',3'':1',6']pyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-3-yl)thio)-N-(p-tolyl)acetamide的定制合成服务?
是的,科弘生物提供2-((11-isobutyl-7,8,9,10-tetrahydro-[1,2,4]triazolo[4'',3'':1',6']pyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-3-yl)thio)-N-(p-tolyl)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。