2-{4-[(4-fluorophenyl)methyl]-1,5-dioxo-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-2(1H)-yl}-N-(2-methoxyphenyl)acetamide
Chemical Structure Depiction of
2-{4-[(4-fluorophenyl)methyl]-1,5-dioxo-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-2(1H)-yl}-N-(2-methoxyphenyl)acetamide
2-{4-[(4-fluorophenyl)methyl]-1,5-dioxo-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-2(1H)-yl}-N-(2-methoxyphenyl)acetamide
Compound characteristics
| Compound ID: | F365-0156 |
| Compound Name: | 2-{4-[(4-fluorophenyl)methyl]-1,5-dioxo-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-2(1H)-yl}-N-(2-methoxyphenyl)acetamide |
| Molecular Weight: | 473.46 |
| Molecular Formula: | C25 H20 F N5 O4 |
| Smiles: | COc1ccccc1NC(CN1C(N2C(=N1)N(Cc1ccc(cc1)F)C(c1ccccc12)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3898 |
| logD: | 3.3898 |
| logSw: | -3.9293 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.017 |
| InChI Key: | HNYRJHJFWFGLJS-UHFFFAOYSA-N |