ethyl 4-[(3-chloro-4-methylphenyl)carbamoyl]-1-ethyl-3,5-dimethyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
ethyl 4-[(3-chloro-4-methylphenyl)carbamoyl]-1-ethyl-3,5-dimethyl-1H-pyrrole-2-carboxylate
ethyl 4-[(3-chloro-4-methylphenyl)carbamoyl]-1-ethyl-3,5-dimethyl-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | C722-0665 |
| Compound Name: | ethyl 4-[(3-chloro-4-methylphenyl)carbamoyl]-1-ethyl-3,5-dimethyl-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 362.85 |
| Molecular Formula: | C19 H23 Cl N2 O3 |
| Smiles: | CCn1c(C)c(C(Nc2ccc(C)c(c2)[Cl])=O)c(C)c1C(=O)OCC |
| Stereo: | ACHIRAL |
| logP: | 4.941 |
| logD: | 4.9153 |
| logSw: | -5.1318 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.806 |
| InChI Key: | BHXHNYRNVHIIML-UHFFFAOYSA-N |