2-[(2-chloro-4-fluorophenyl)methyl]-4-(3-methylbutyl)-2,4-dihydro[1,2,4]triazolo[4,3-a]quinazoline-1,5-dione
Chemical Structure Depiction of
2-[(2-chloro-4-fluorophenyl)methyl]-4-(3-methylbutyl)-2,4-dihydro[1,2,4]triazolo[4,3-a]quinazoline-1,5-dione
2-[(2-chloro-4-fluorophenyl)methyl]-4-(3-methylbutyl)-2,4-dihydro[1,2,4]triazolo[4,3-a]quinazoline-1,5-dione
Compound characteristics
| Compound ID: | F366-0087 |
| Compound Name: | 2-[(2-chloro-4-fluorophenyl)methyl]-4-(3-methylbutyl)-2,4-dihydro[1,2,4]triazolo[4,3-a]quinazoline-1,5-dione |
| Molecular Weight: | 414.87 |
| Molecular Formula: | C21 H20 Cl F N4 O2 |
| Smiles: | CC(C)CCN1C2=NN(Cc3ccc(cc3[Cl])F)C(N2c2ccccc2C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8596 |
| logD: | 4.8596 |
| logSw: | -4.879 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 48.185 |
| InChI Key: | TXMSKCFKNOEQDL-UHFFFAOYSA-N |