2-(4-benzyl-1,5-dioxo-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-2(1H)-yl)-N-[(4-chlorophenyl)methyl]acetamide
Chemical Structure Depiction of
2-(4-benzyl-1,5-dioxo-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-2(1H)-yl)-N-[(4-chlorophenyl)methyl]acetamide
2-(4-benzyl-1,5-dioxo-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-2(1H)-yl)-N-[(4-chlorophenyl)methyl]acetamide
Compound characteristics
| Compound ID: | F365-0148 |
| Compound Name: | 2-(4-benzyl-1,5-dioxo-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-2(1H)-yl)-N-[(4-chlorophenyl)methyl]acetamide |
| Molecular Weight: | 473.92 |
| Molecular Formula: | C25 H20 Cl N5 O3 |
| Smiles: | C(c1ccc(cc1)[Cl])NC(CN1C(N2C(=N1)N(Cc1ccccc1)C(c1ccccc12)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7801 |
| logD: | 3.7801 |
| logSw: | -4.441 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.407 |
| InChI Key: | YNKFOXPNVCOCLT-UHFFFAOYSA-N |