propyl 4-{4-[(4-ethoxy-3-methoxyphenyl)methylidene]-5-oxo-3-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl}benzoate
Chemical Structure Depiction of
propyl 4-{4-[(4-ethoxy-3-methoxyphenyl)methylidene]-5-oxo-3-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl}benzoate
propyl 4-{4-[(4-ethoxy-3-methoxyphenyl)methylidene]-5-oxo-3-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl}benzoate
Compound characteristics
| Compound ID: | 5618-0077 |
| Compound Name: | propyl 4-{4-[(4-ethoxy-3-methoxyphenyl)methylidene]-5-oxo-3-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl}benzoate |
| Molecular Weight: | 476.45 |
| Molecular Formula: | C24 H23 F3 N2 O5 |
| Smiles: | CCCOC(c1ccc(cc1)N1C(C(=C/c2ccc(c(c2)OC)OCC)\C(C(F)(F)F)=N1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0907 |
| logD: | 5.0907 |
| logSw: | -5.0296 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 62.302 |
| InChI Key: | XDDCMKQSWJESHU-UHFFFAOYSA-N |