ethyl 4-[ethyl(phenyl)carbamoyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
ethyl 4-[ethyl(phenyl)carbamoyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate
ethyl 4-[ethyl(phenyl)carbamoyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | E137-0061 |
| Compound Name: | ethyl 4-[ethyl(phenyl)carbamoyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 314.38 |
| Molecular Formula: | C18 H22 N2 O3 |
| Smiles: | CCN(C(c1c(C)c(C(=O)OCC)[nH]c1C)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 3.3027 |
| logD: | 3.3027 |
| logSw: | -3.4492 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.321 |
| InChI Key: | VUYAUAQGFGSRJD-UHFFFAOYSA-N |