methyl 2-[2-(4-benzylpiperazin-1-yl)acetamido]-5-carbamoyl-4-methylthiophene-3-carboxylate
Chemical Structure Depiction of
methyl 2-[2-(4-benzylpiperazin-1-yl)acetamido]-5-carbamoyl-4-methylthiophene-3-carboxylate
methyl 2-[2-(4-benzylpiperazin-1-yl)acetamido]-5-carbamoyl-4-methylthiophene-3-carboxylate
Compound characteristics
| Compound ID: | Y200-6264 |
| Compound Name: | methyl 2-[2-(4-benzylpiperazin-1-yl)acetamido]-5-carbamoyl-4-methylthiophene-3-carboxylate |
| Molecular Weight: | 430.52 |
| Molecular Formula: | C21 H26 N4 O4 S |
| Smiles: | Cc1c(C(=O)OC)c(NC(CN2CCN(CC2)Cc2ccccc2)=O)sc1C(N)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6566 |
| logD: | -1.4564 |
| logSw: | -2.3684 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 85.688 |
| InChI Key: | QSOIVKIITBJZQW-UHFFFAOYSA-N |