ethyl 4-[(4-bromo-2-methylphenyl)carbamoyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
ethyl 4-[(4-bromo-2-methylphenyl)carbamoyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate
ethyl 4-[(4-bromo-2-methylphenyl)carbamoyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | C722-0193 |
| Compound Name: | ethyl 4-[(4-bromo-2-methylphenyl)carbamoyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 379.25 |
| Molecular Formula: | C17 H19 Br N2 O3 |
| Smiles: | [H]n1c(C)c(C(Nc2ccc(cc2C)[Br])=O)c(C)c1C(=O)OCC |
| Stereo: | ACHIRAL |
| logP: | 4.132 |
| logD: | 4.0905 |
| logSw: | -4.3055 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 54.367 |
| InChI Key: | LJXCFTPYERNKTN-UHFFFAOYSA-N |