ethyl 4-[3-acetamido-4-(4-methylbenzene-1-sulfonyl)benzoyl]piperazine-1-carboxylate
Chemical Structure Depiction of
ethyl 4-[3-acetamido-4-(4-methylbenzene-1-sulfonyl)benzoyl]piperazine-1-carboxylate
ethyl 4-[3-acetamido-4-(4-methylbenzene-1-sulfonyl)benzoyl]piperazine-1-carboxylate
Compound characteristics
| Compound ID: | K786-9413 |
| Compound Name: | ethyl 4-[3-acetamido-4-(4-methylbenzene-1-sulfonyl)benzoyl]piperazine-1-carboxylate |
| Molecular Weight: | 473.55 |
| Molecular Formula: | C23 H27 N3 O6 S |
| Smiles: | CCOC(N1CCN(CC1)C(c1ccc(c(c1)NC(C)=O)S(c1ccc(C)cc1)(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0163 |
| logD: | 2.0163 |
| logSw: | -2.816 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 91.732 |
| InChI Key: | WTXMQIDVFOAKCJ-UHFFFAOYSA-N |