ethyl 4-[4-(benzylcarbamoyl)piperidine-1-sulfonyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
ethyl 4-[4-(benzylcarbamoyl)piperidine-1-sulfonyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate
ethyl 4-[4-(benzylcarbamoyl)piperidine-1-sulfonyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | G070-0169 |
| Compound Name: | ethyl 4-[4-(benzylcarbamoyl)piperidine-1-sulfonyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 447.55 |
| Molecular Formula: | C22 H29 N3 O5 S |
| Smiles: | CCOC(c1c(c(C)[nH]c1C)S(N1CCC(CC1)C(NCc1ccccc1)=O)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.97 |
| logD: | 1.97 |
| logSw: | -2.333 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 87.904 |
| InChI Key: | DDBICOBYVHVGCR-UHFFFAOYSA-N |