4-[(4-fluorophenyl)methyl]-1-(2-hydroxy-4-methoxyphenyl)[1,2,4]triazolo[4,3-a]quinazolin-5(4H)-one
Chemical Structure Depiction of
4-[(4-fluorophenyl)methyl]-1-(2-hydroxy-4-methoxyphenyl)[1,2,4]triazolo[4,3-a]quinazolin-5(4H)-one
4-[(4-fluorophenyl)methyl]-1-(2-hydroxy-4-methoxyphenyl)[1,2,4]triazolo[4,3-a]quinazolin-5(4H)-one
Compound characteristics
| Compound ID: | E143-0103 |
| Compound Name: | 4-[(4-fluorophenyl)methyl]-1-(2-hydroxy-4-methoxyphenyl)[1,2,4]triazolo[4,3-a]quinazolin-5(4H)-one |
| Molecular Weight: | 416.41 |
| Molecular Formula: | C23 H17 F N4 O3 |
| Smiles: | COc1ccc(c(c1)O)c1nnc2N(Cc3ccc(cc3)F)C(c3ccccc3n12)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0876 |
| logD: | 4.0292 |
| logSw: | -4.0401 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.822 |
| InChI Key: | XVCXVVWBOCTMNK-UHFFFAOYSA-N |