N-(3,5-dimethoxyphenyl)-2-{4-[(4-fluorophenyl)methyl]-1,5-dioxo-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-2(1H)-yl}acetamide
Chemical Structure Depiction of
N-(3,5-dimethoxyphenyl)-2-{4-[(4-fluorophenyl)methyl]-1,5-dioxo-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-2(1H)-yl}acetamide
N-(3,5-dimethoxyphenyl)-2-{4-[(4-fluorophenyl)methyl]-1,5-dioxo-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-2(1H)-yl}acetamide
Compound characteristics
| Compound ID: | F365-0169 |
| Compound Name: | N-(3,5-dimethoxyphenyl)-2-{4-[(4-fluorophenyl)methyl]-1,5-dioxo-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-2(1H)-yl}acetamide |
| Molecular Weight: | 503.49 |
| Molecular Formula: | C26 H22 F N5 O5 |
| Smiles: | COc1cc(cc(c1)OC)NC(CN1C(N2C(=N1)N(Cc1ccc(cc1)F)C(c1ccccc12)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7758 |
| logD: | 3.7757 |
| logSw: | -4.0367 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.172 |
| InChI Key: | AFSLTYDVIJHDDQ-UHFFFAOYSA-N |