ethyl 4-[(4-bromo-3-methylphenyl)carbamoyl]-1,3,5-trimethyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
ethyl 4-[(4-bromo-3-methylphenyl)carbamoyl]-1,3,5-trimethyl-1H-pyrrole-2-carboxylate
ethyl 4-[(4-bromo-3-methylphenyl)carbamoyl]-1,3,5-trimethyl-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | C722-0442 |
| Compound Name: | ethyl 4-[(4-bromo-3-methylphenyl)carbamoyl]-1,3,5-trimethyl-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 393.28 |
| Molecular Formula: | C18 H21 Br N2 O3 |
| Smiles: | CCOC(c1c(C)c(C(Nc2ccc(c(C)c2)[Br])=O)c(C)n1C)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1074 |
| logD: | 4.0967 |
| logSw: | -4.3214 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.892 |
| InChI Key: | MCWXUOQFDYDEIY-UHFFFAOYSA-N |