Methyl 4-carbamoyl-2,5-dimethyl-1-(phenylcarbamoylamino)pyrrole-3-carboxylate
概要：Methyl 4-carbamoyl-2,5-dimethyl-1-(phenylcarbamoylamino)pyrrole-3-carboxylate（CAS 94126-66-6）是一种化学化合物，分子式为C16H18N4O4，分子量为330.13 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。
methyl 4-carbamoyl-2,5-dimethyl-1-(phenylcarbamoylamino)pyrrole-3-carboxylate
又称：3-Phenylcarbamoylazo-crotonsaeure-aethylester, methyl 4-carbamoyl-2,5-dimethyl-1-(phenylcarbamoylamino)pyrrole-3-carboxylate, methyl 4-carbamoyl-2,5-dimethyl-1-(phenylcarbamoylamino)pyrr, Methyl 4-carbamoyl-2,5-dimethyl-1-[(phenylcarbamoyl)amino]-1H-pyrrole-3-carboxylate
| 分子式 | C16H18N4O4 |
|---|---|
| 分子量 | 330.13 g/mol |
| LogP | 1.2 |
| 拓扑极性表面积 | 115.0 Ų |
| 氢键供体数 | 3 |
| 氢键受体数 | 4 |
| 可旋转键数 | 5 |
| 精确质量 | 330.1328 |
| 重原子数 | 24 |
| 复杂度 | 492.0 |
化学标识符
| CAS 编号 | 94126-66-6 |
|---|---|
| SMILES | CC1=C(C(=C(N1NC(=O)NC2=CC=CC=C2)C)C(=O)OC)C(=O)N |
| InChIKey | RBMFRTPRBGXGGL-UHFFFAOYSA-N |
产品概述
Methyl 4-carbamoyl-2,5-dimethyl-1-(phenylcarbamoylamino)pyrrole-3-carboxylate（CAS 94126-66-6），分子式为C16H18N4O4，分子量为330.13 g/mol。IUPAC名：methyl 4-carbamoyl-2,5-dimethyl-1-(phenylcarbamoylamino)pyrrole-3-carboxylate。
Methyl 4-carbamoyl-2,5-dimethyl-1-(phenylcarbamoylamino)pyrrole-3-carboxylate化学性质概览
属性洞察：Methyl 4-carbamoyl-2,5-dimethyl-1-(phenylcarbamoylamino)pyrrole-3-carboxylate
Methyl 4-carbamoyl-2,5-dimethyl-1-(phenylcarbamoylamino)pyrrole-3-carboxylate的XLogP值为1.2，表明具有中等亲脂性，在水溶性和膜透过性之间取得平衡。 TPSA为115.0 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，Methyl 4-carbamoyl-2,5-dimethyl-1-(phenylcarbamoylamino)pyrrole-3-carboxylate有3个氢键供体和4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
Methyl 4-carbamoyl-2,5-dimethyl-1-(phenylcarbamoylamino)pyrrole-3-carboxylate的CAS号是多少？
Methyl 4-carbamoyl-2,5-dimethyl-1-(phenylcarbamoylamino)pyrrole-3-carboxylate的CAS号为94126-66-6。
Methyl 4-carbamoyl-2,5-dimethyl-1-(phenylcarbamoylamino)pyrrole-3-carboxylate的分子式是什么？
Methyl 4-carbamoyl-2,5-dimethyl-1-(phenylcarbamoylamino)pyrrole-3-carboxylate的分子式为C16H18N4O4。
Methyl 4-carbamoyl-2,5-dimethyl-1-(phenylcarbamoylamino)pyrrole-3-carboxylate的分子量是多少？
Methyl 4-carbamoyl-2,5-dimethyl-1-(phenylcarbamoylamino)pyrrole-3-carboxylate的分子量为330.13 g/mol。
在哪里可以购买Methyl 4-carbamoyl-2,5-dimethyl-1-(phenylcarbamoylamino)pyrrole-3-carboxylate？
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