ethyl 4-[(4-bromo-2-fluorophenyl)carbamoyl]-1-ethyl-3,5-dimethyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
ethyl 4-[(4-bromo-2-fluorophenyl)carbamoyl]-1-ethyl-3,5-dimethyl-1H-pyrrole-2-carboxylate
ethyl 4-[(4-bromo-2-fluorophenyl)carbamoyl]-1-ethyl-3,5-dimethyl-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | C722-0649 |
| Compound Name: | ethyl 4-[(4-bromo-2-fluorophenyl)carbamoyl]-1-ethyl-3,5-dimethyl-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 411.27 |
| Molecular Formula: | C18 H20 Br F N2 O3 |
| Smiles: | CCn1c(C)c(C(Nc2ccc(cc2F)[Br])=O)c(C)c1C(=O)OCC |
| Stereo: | ACHIRAL |
| logP: | 4.4295 |
| logD: | 3.8358 |
| logSw: | -4.3994 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.109 |
| InChI Key: | WLILQHOLBIMUSD-UHFFFAOYSA-N |