ethyl 2-methyl-4-oxo-5-{[2-(trifluoromethyl)phenyl]methylidene}-4,5-dihydro-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
ethyl 2-methyl-4-oxo-5-{[2-(trifluoromethyl)phenyl]methylidene}-4,5-dihydro-1H-pyrrole-3-carboxylate
ethyl 2-methyl-4-oxo-5-{[2-(trifluoromethyl)phenyl]methylidene}-4,5-dihydro-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | 5079-1278 |
| Compound Name: | ethyl 2-methyl-4-oxo-5-{[2-(trifluoromethyl)phenyl]methylidene}-4,5-dihydro-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 325.29 |
| Molecular Formula: | C16 H14 F3 N O3 |
| Smiles: | CCOC(C1=C(C)NC(=C/c2ccccc2C(F)(F)F)\C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7952 |
| logD: | 3.3801 |
| logSw: | -4.018 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.064 |
| InChI Key: | HDBBGSLUKMZQDN-UHFFFAOYSA-N |