ethyl 4-{4-[benzyl(ethyl)carbamoyl]piperidine-1-sulfonyl}-2,5-dimethyl-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
ethyl 4-{4-[benzyl(ethyl)carbamoyl]piperidine-1-sulfonyl}-2,5-dimethyl-1H-pyrrole-3-carboxylate
ethyl 4-{4-[benzyl(ethyl)carbamoyl]piperidine-1-sulfonyl}-2,5-dimethyl-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | G070-0161 |
| Compound Name: | ethyl 4-{4-[benzyl(ethyl)carbamoyl]piperidine-1-sulfonyl}-2,5-dimethyl-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 475.61 |
| Molecular Formula: | C24 H33 N3 O5 S |
| Smiles: | CCN(Cc1ccccc1)C(C1CCN(CC1)S(c1c(C(=O)OCC)c(C)[nH]c1C)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8031 |
| logD: | 2.8031 |
| logSw: | -3.0923 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.427 |
| InChI Key: | SHJSMFUFEWVOEM-UHFFFAOYSA-N |