methyl 5-carbamoyl-2-{2-[4-(4-methoxyphenyl)piperazin-1-yl]acetamido}-4-methylthiophene-3-carboxylate
Chemical Structure Depiction of
methyl 5-carbamoyl-2-{2-[4-(4-methoxyphenyl)piperazin-1-yl]acetamido}-4-methylthiophene-3-carboxylate
methyl 5-carbamoyl-2-{2-[4-(4-methoxyphenyl)piperazin-1-yl]acetamido}-4-methylthiophene-3-carboxylate
Compound characteristics
| Compound ID: | Y200-6238 |
| Compound Name: | methyl 5-carbamoyl-2-{2-[4-(4-methoxyphenyl)piperazin-1-yl]acetamido}-4-methylthiophene-3-carboxylate |
| Molecular Weight: | 446.52 |
| Molecular Formula: | C21 H26 N4 O5 S |
| Smiles: | Cc1c(C(=O)OC)c(NC(CN2CCN(CC2)c2ccc(cc2)OC)=O)sc1C(N)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0794 |
| logD: | -1.0335 |
| logSw: | -2.7679 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 92.952 |
| InChI Key: | BRJAXEUJPWDOOA-UHFFFAOYSA-N |