methyl 1-[3-(4-methylpiperazine-1-sulfonyl)benzoyl]piperidine-4-carboxylate
Chemical Structure Depiction of
methyl 1-[3-(4-methylpiperazine-1-sulfonyl)benzoyl]piperidine-4-carboxylate
methyl 1-[3-(4-methylpiperazine-1-sulfonyl)benzoyl]piperidine-4-carboxylate
Compound characteristics
| Compound ID: | Y300-1746 |
| Compound Name: | methyl 1-[3-(4-methylpiperazine-1-sulfonyl)benzoyl]piperidine-4-carboxylate |
| Molecular Weight: | 409.5 |
| Molecular Formula: | C19 H27 N3 O5 S |
| Smiles: | CN1CCN(CC1)S(c1cccc(c1)C(N1CCC(CC1)C(=O)OC)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.4441 |
| logD: | 0.3815 |
| logSw: | -2.1986 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 73.248 |
| InChI Key: | KQSAIQLIOXCZSS-UHFFFAOYSA-N |