ethyl 4-{[4-chloro-3-(trifluoromethyl)phenyl]carbamoyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
ethyl 4-{[4-chloro-3-(trifluoromethyl)phenyl]carbamoyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate
ethyl 4-{[4-chloro-3-(trifluoromethyl)phenyl]carbamoyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | E137-0018 |
| Compound Name: | ethyl 4-{[4-chloro-3-(trifluoromethyl)phenyl]carbamoyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 388.77 |
| Molecular Formula: | C17 H16 Cl F3 N2 O3 |
| Smiles: | CCOC(c1c(C)c(C(Nc2ccc(c(c2)C(F)(F)F)[Cl])=O)c(C)[nH]1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7228 |
| logD: | 3.526 |
| logSw: | -5.1012 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 55.065 |
| InChI Key: | BBAWUZGWBGNMAV-UHFFFAOYSA-N |