1-(3,4-dimethoxyphenyl)-4-[(4-fluorophenyl)methyl][1,2,4]triazolo[4,3-a]quinazolin-5(4H)-one
Chemical Structure Depiction of
1-(3,4-dimethoxyphenyl)-4-[(4-fluorophenyl)methyl][1,2,4]triazolo[4,3-a]quinazolin-5(4H)-one
1-(3,4-dimethoxyphenyl)-4-[(4-fluorophenyl)methyl][1,2,4]triazolo[4,3-a]quinazolin-5(4H)-one
Compound characteristics
| Compound ID: | E143-0115 |
| Compound Name: | 1-(3,4-dimethoxyphenyl)-4-[(4-fluorophenyl)methyl][1,2,4]triazolo[4,3-a]quinazolin-5(4H)-one |
| Molecular Weight: | 430.44 |
| Molecular Formula: | C24 H19 F N4 O3 |
| Smiles: | COc1ccc(cc1OC)c1nnc2N(Cc3ccc(cc3)F)C(c3ccccc3n12)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7823 |
| logD: | 3.7823 |
| logSw: | -4.0526 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 53.991 |
| InChI Key: | PXUBGKVTMZQMNJ-UHFFFAOYSA-N |