1-(4-hydroxy-3,5-dimethoxyphenyl)-4-(2-phenylethyl)[1,2,4]triazolo[4,3-a]quinazolin-5(4H)-one
Chemical Structure Depiction of
1-(4-hydroxy-3,5-dimethoxyphenyl)-4-(2-phenylethyl)[1,2,4]triazolo[4,3-a]quinazolin-5(4H)-one
1-(4-hydroxy-3,5-dimethoxyphenyl)-4-(2-phenylethyl)[1,2,4]triazolo[4,3-a]quinazolin-5(4H)-one
Compound characteristics
| Compound ID: | E143-0228 |
| Compound Name: | 1-(4-hydroxy-3,5-dimethoxyphenyl)-4-(2-phenylethyl)[1,2,4]triazolo[4,3-a]quinazolin-5(4H)-one |
| Molecular Weight: | 442.47 |
| Molecular Formula: | C25 H22 N4 O4 |
| Smiles: | COc1cc(cc(c1O)OC)c1nnc2N(CCc3ccccc3)C(c3ccccc3n12)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0158 |
| logD: | 2.98 |
| logSw: | -3.4225 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.449 |
| InChI Key: | ZKZBALNAMPYXSK-UHFFFAOYSA-N |