ethyl 3-[1-(dimethylamino)ethylideneamino]-5-methyl-1H-indole-2-carboxylate
概要:ethyl 3-[1-(dimethylamino)ethylideneamino]-5-methyl-1H-indole-2-carboxylate(CAS 1164486-45-6)是一种化学化合物,分子式为C16H21N3O2,分子量为287.16 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。
ethyl 3-[1-(dimethylamino)ethylideneamino]-5-methyl-1H-indole-2-carboxylate
又称:ethyl 3-[1-(dimethylamino)ethylideneamino]-5-methyl-1H-indole-2-carboxylate, ethyl 3-{[1-(dimethylamino)ethylidene]amino}-5-methyl-1H-indole-2-carboxylate, (E)-ethyl 3-((1-(dimethylamino)ethylidene)amino)-5-methyl-1H-indole-2-carboxylate, 3-[1-Dimethylamino-eth-(E)-ylideneamino]-5-methyl-1H-indole-2-carboxylic acid ethyl ester, ethyl 3-[(1E)-2-(dimethylamino)-1-azaprop-1-enyl]-5-methylindole-2-carboxylate
| 分子式 | C16H21N3O2 |
|---|---|
| 分子量 | 287.16 g/mol |
| LogP | 2.6 |
| 拓扑极性表面积 | 57.7 Ų |
| 氢键供体数 | 1 |
| 氢键受体数 | 3 |
| 可旋转键数 | 5 |
| 精确质量 | 287.1634 |
| 重原子数 | 21 |
| 复杂度 | 408.0 |
化学标识符
| CAS 编号 | 1164486-45-6 |
|---|---|
| SMILES | CCOC(=O)C1=C(C2=C(N1)C=CC(=C2)C)N=C(C)N(C)C |
| InChIKey | WZCMVJLPLZEZLZ-UHFFFAOYSA-N |
产品概述
ethyl 3-[1-(dimethylamino)ethylideneamino]-5-methyl-1H-indole-2-carboxylate(CAS 1164486-45-6),分子式为C16H21N3O2,分子量为287.16 g/mol。IUPAC名:ethyl 3-[1-(dimethylamino)ethylideneamino]-5-methyl-1H-indole-2-carboxylate。
ethyl 3-[1-(dimethylamino)ethylideneamino]-5-methyl-1H-indole-2-carboxylate化学性质概览
属性洞察:ethyl 3-[1-(dimethylamino)ethylideneamino]-5-methyl-1H-indole-2-carboxylate
ethyl 3-[1-(dimethylamino)ethylideneamino]-5-methyl-1H-indole-2-carboxylate的XLogP值为2.6,表明具有中等亲脂性,在水溶性和膜透过性之间取得平衡。 ethyl 3-[1-(dimethylamino)ethylideneamino]-5-methyl-1H-indole-2-carboxylate的拓扑极性表面积(TPSA)为57.7 Ų,极性较低,可能具有较好的细胞膜透过性。 根据Lipinski五规则,ethyl 3-[1-(dimethylamino)ethylideneamino]-5-methyl-1H-indole-2-carboxylate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
ethyl 3-[1-(dimethylamino)ethylideneamino]-5-methyl-1H-indole-2-carboxylate的CAS号是多少?
ethyl 3-[1-(dimethylamino)ethylideneamino]-5-methyl-1H-indole-2-carboxylate的CAS号为1164486-45-6。
ethyl 3-[1-(dimethylamino)ethylideneamino]-5-methyl-1H-indole-2-carboxylate的分子式是什么?
ethyl 3-[1-(dimethylamino)ethylideneamino]-5-methyl-1H-indole-2-carboxylate的分子式为C16H21N3O2。
ethyl 3-[1-(dimethylamino)ethylideneamino]-5-methyl-1H-indole-2-carboxylate的分子量是多少?
ethyl 3-[1-(dimethylamino)ethylideneamino]-5-methyl-1H-indole-2-carboxylate的分子量为287.16 g/mol。
在哪里可以购买ethyl 3-[1-(dimethylamino)ethylideneamino]-5-methyl-1H-indole-2-carboxylate?
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