4-[(4-methylphenyl)methyl]-2-{[3-(trifluoromethyl)phenyl]methyl}-2,4-dihydro[1,2,4]triazolo[4,3-a]quinazoline-1,5-dione
Chemical Structure Depiction of
4-[(4-methylphenyl)methyl]-2-{[3-(trifluoromethyl)phenyl]methyl}-2,4-dihydro[1,2,4]triazolo[4,3-a]quinazoline-1,5-dione
4-[(4-methylphenyl)methyl]-2-{[3-(trifluoromethyl)phenyl]methyl}-2,4-dihydro[1,2,4]triazolo[4,3-a]quinazoline-1,5-dione
Compound characteristics
| Compound ID: | F366-0212 |
| Compound Name: | 4-[(4-methylphenyl)methyl]-2-{[3-(trifluoromethyl)phenyl]methyl}-2,4-dihydro[1,2,4]triazolo[4,3-a]quinazoline-1,5-dione |
| Molecular Weight: | 464.45 |
| Molecular Formula: | C25 H19 F3 N4 O2 |
| Smiles: | Cc1ccc(CN2C3=NN(Cc4cccc(c4)C(F)(F)F)C(N3c3ccccc3C2=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.2097 |
| logD: | 5.2097 |
| logSw: | -5.1756 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 47.935 |
| InChI Key: | ISSCMMLIXZLAOI-UHFFFAOYSA-N |