ethyl 4-[(3,4-difluorophenyl)carbamoyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
ethyl 4-[(3,4-difluorophenyl)carbamoyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate
ethyl 4-[(3,4-difluorophenyl)carbamoyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | C722-0173 |
| Compound Name: | ethyl 4-[(3,4-difluorophenyl)carbamoyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 322.31 |
| Molecular Formula: | C16 H16 F2 N2 O3 |
| Smiles: | [H]n1c(C)c(C(Nc2ccc(c(c2)F)F)=O)c(C)c1C(=O)OCC |
| Stereo: | ACHIRAL |
| logP: | 3.4722 |
| logD: | 2.7414 |
| logSw: | -3.8708 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 55.065 |
| InChI Key: | DMFPDTCTUHRJMX-UHFFFAOYSA-N |