ethyl 2-methyl-4-{[3-(trifluoromethyl)phenyl]methyl}-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
ethyl 2-methyl-4-{[3-(trifluoromethyl)phenyl]methyl}-1H-pyrrole-3-carboxylate
ethyl 2-methyl-4-{[3-(trifluoromethyl)phenyl]methyl}-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | 8017-5394 |
| Compound Name: | ethyl 2-methyl-4-{[3-(trifluoromethyl)phenyl]methyl}-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 311.3 |
| Molecular Formula: | C16 H16 F3 N O2 |
| Smiles: | CCOC(c1c(Cc2cccc(c2)C(F)(F)F)c[nH]c1C)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1848 |
| logD: | 4.1848 |
| logSw: | -4.4521 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 31.4532 |
| InChI Key: | XWWFHXGFEJTAEM-UHFFFAOYSA-N |