ethyl 2-[2-(4-benzylpiperazin-1-yl)acetamido]-5-carbamoyl-4-methylthiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-[2-(4-benzylpiperazin-1-yl)acetamido]-5-carbamoyl-4-methylthiophene-3-carboxylate
ethyl 2-[2-(4-benzylpiperazin-1-yl)acetamido]-5-carbamoyl-4-methylthiophene-3-carboxylate
Compound characteristics
| Compound ID: | Y200-6313 |
| Compound Name: | ethyl 2-[2-(4-benzylpiperazin-1-yl)acetamido]-5-carbamoyl-4-methylthiophene-3-carboxylate |
| Molecular Weight: | 444.55 |
| Molecular Formula: | C22 H28 N4 O4 S |
| Smiles: | CCOC(c1c(C)c(C(N)=O)sc1NC(CN1CCN(CC1)Cc1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0389 |
| logD: | -1.0741 |
| logSw: | -2.6439 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 85.268 |
| InChI Key: | ANRBVGCDTCSEBE-UHFFFAOYSA-N |