![methyl 2-({[1-(2-chlorobenzyl)-3,5-dimethyl-1H-pyrazol-4-yl]carbamothioyl}amino)-5-methylthiophene-3-carboxylate structure](/static/products/5887/588713-70-6.webp)
methyl 2-({[1-(2-chlorobenzyl)-3,5-dimethyl-1H-pyrazol-4-yl]carbamothioyl}amino)-5-methylthiophene-3-carboxylate
概要：methyl 2-({[1-(2-chlorobenzyl)-3,5-dimethyl-1H-pyrazol-4-yl]carbamothioyl}amino)-5-methylthiophene-3-carboxylate（CAS 588713-70-6）是一种化学化合物，分子式为C20H21ClN4O2S2，分子量为448.08 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 2-[[1-[(2-chlorophenyl)methyl]-3,5-dimethylpyrazol-4-yl]carbamothioylamino]-5-methylthiophene-3-carboxylate
又称：methyl 2-({[1-(2-chlorobenzyl)-3,5-dimethyl-1H-pyrazol-4-yl]carbamothioyl}amino)-5-methylthiophene-3-carboxylate, methyl 2-(3-(1-(2-chlorobenzyl)-3,5-dimethyl-1H-pyrazol-4-yl)thioureido)-5-methylthiophene-3-carboxylate, methyl 2-[[1-[(2-chlorophenyl)methyl]-3,5-dimethylpyrazol-4-yl]carbamothioylamino]-5-methylthiophene-3-carboxylate, methyl 2-{[({1-[(2-chlorophenyl)methyl]-3,5-dimethylpyrazol-4-yl}amino)thioxom ethyl]amino}-5-methylthiophene-3-carboxylate
| 分子式 | C20H21ClN4O2S2 |
|---|---|
| 分子量 | 448.08 g/mol |
| LogP | 5.16706 |
| 拓扑极性表面积 | 68.18 Ų |
| 氢键供体数 | 2 |
| 氢键受体数 | 5 |
| 可旋转键数 | 5 |
| 精确质量 | 448.07944 |
| 重原子数 | 29 |
| 复杂度 | 1074.6183 |
化学标识符
| CAS 编号 | 588713-70-6 |
|---|---|
| SMILES | CC1=CC(=C(S1)NC(=S)NC2=C(N(N=C2C)CC3=CC=CC=C3Cl)C)C(=O)OC |
产品概述
methyl 2-({[1-(2-chlorobenzyl)-3,5-dimethyl-1H-pyrazol-4-yl]carbamothioyl}amino)-5-methylthiophene-3-carboxylate（CAS 588713-70-6），分子式为C20H21ClN4O2S2，分子量为448.08 g/mol。IUPAC名：methyl 2-[[1-[(2-chlorophenyl)methyl]-3,5-dimethylpyrazol-4-yl]carbamothioylamino]-5-methylthiophene-3-carboxylate。
methyl 2-({[1-(2-chlorobenzyl)-3,5-dimethyl-1H-pyrazol-4-yl]carbamothioyl}amino)-5-methylthiophene-3-carboxylate化学性质概览
属性洞察：methyl 2-({[1-(2-chlorobenzyl)-3,5-dimethyl-1H-pyrazol-4-yl]carbamothioyl}amino)-5-methylthiophene-3-carboxylate
methyl 2-({[1-(2-chlorobenzyl)-3,5-dimethyl-1H-pyrazol-4-yl]carbamothioyl}amino)-5-methylthiophene-3-carboxylate的XLogP值为5.16706，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68.18 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 2-({[1-(2-chlorobenzyl)-3,5-dimethyl-1H-pyrazol-4-yl]carbamothioyl}amino)-5-methylthiophene-3-carboxylate有2个氢键供体和5个氢键受体，可能需要考虑配方优化。
常见问题
常见问题
methyl 2-({[1-(2-chlorobenzyl)-3,5-dimethyl-1H-pyrazol-4-yl]carbamothioyl}amino)-5-methylthiophene-3-carboxylate的CAS号是多少？
methyl 2-({[1-(2-chlorobenzyl)-3,5-dimethyl-1H-pyrazol-4-yl]carbamothioyl}amino)-5-methylthiophene-3-carboxylate的CAS号为588713-70-6。
methyl 2-({[1-(2-chlorobenzyl)-3,5-dimethyl-1H-pyrazol-4-yl]carbamothioyl}amino)-5-methylthiophene-3-carboxylate的分子式是什么？
methyl 2-({[1-(2-chlorobenzyl)-3,5-dimethyl-1H-pyrazol-4-yl]carbamothioyl}amino)-5-methylthiophene-3-carboxylate的分子式为C20H21ClN4O2S2。
methyl 2-({[1-(2-chlorobenzyl)-3,5-dimethyl-1H-pyrazol-4-yl]carbamothioyl}amino)-5-methylthiophene-3-carboxylate的分子量是多少？
methyl 2-({[1-(2-chlorobenzyl)-3,5-dimethyl-1H-pyrazol-4-yl]carbamothioyl}amino)-5-methylthiophene-3-carboxylate的分子量为448.08 g/mol。
在哪里可以购买methyl 2-({[1-(2-chlorobenzyl)-3,5-dimethyl-1H-pyrazol-4-yl]carbamothioyl}amino)-5-methylthiophene-3-carboxylate？
您可以直接向科弘生物询价methyl 2-({[1-(2-chlorobenzyl)-3,5-dimethyl-1H-pyrazol-4-yl]carbamothioyl}amino)-5-methylthiophene-3-carboxylate。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methyl 2-({[1-(2-chlorobenzyl)-3,5-dimethyl-1H-pyrazol-4-yl]carbamothioyl}amino)-5-methylthiophene-3-carboxylate的定制合成服务？
是的，科弘生物提供methyl 2-({[1-(2-chlorobenzyl)-3,5-dimethyl-1H-pyrazol-4-yl]carbamothioyl}amino)-5-methylthiophene-3-carboxylate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。