3-(4-methoxyphenyl)-4-oxo-N-[3-(trifluoromethyl)phenyl]-3,4-dihydrophthalazine-1-carboxamide
Chemical Structure Depiction of
3-(4-methoxyphenyl)-4-oxo-N-[3-(trifluoromethyl)phenyl]-3,4-dihydrophthalazine-1-carboxamide
3-(4-methoxyphenyl)-4-oxo-N-[3-(trifluoromethyl)phenyl]-3,4-dihydrophthalazine-1-carboxamide
Compound characteristics
| Compound ID: | K999-0012 |
| Compound Name: | 3-(4-methoxyphenyl)-4-oxo-N-[3-(trifluoromethyl)phenyl]-3,4-dihydrophthalazine-1-carboxamide |
| Molecular Weight: | 439.39 |
| Molecular Formula: | C23 H16 F3 N3 O3 |
| Smiles: | COc1ccc(cc1)N1C(c2ccccc2C(C(Nc2cccc(c2)C(F)(F)F)=O)=N1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7537 |
| logD: | 4.7126 |
| logSw: | -4.5748 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.683 |
| InChI Key: | VAHCBVWOKVMTJG-UHFFFAOYSA-N |