ethyl 1-ethyl-3,5-dimethyl-4-{[4-(trifluoromethoxy)phenyl]carbamoyl}-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
ethyl 1-ethyl-3,5-dimethyl-4-{[4-(trifluoromethoxy)phenyl]carbamoyl}-1H-pyrrole-2-carboxylate
ethyl 1-ethyl-3,5-dimethyl-4-{[4-(trifluoromethoxy)phenyl]carbamoyl}-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | C722-0623 |
| Compound Name: | ethyl 1-ethyl-3,5-dimethyl-4-{[4-(trifluoromethoxy)phenyl]carbamoyl}-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 398.38 |
| Molecular Formula: | C19 H21 F3 N2 O4 |
| Smiles: | CCn1c(C)c(C(Nc2ccc(cc2)OC(F)(F)F)=O)c(C)c1C(=O)OCC |
| Stereo: | ACHIRAL |
| logP: | 4.742 |
| logD: | 4.7414 |
| logSw: | -4.6447 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.743 |
| InChI Key: | HCHNLNWQFZZWQA-UHFFFAOYSA-N |