2-(4-benzyl-1,5-dioxo-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-2(1H)-yl)-N-(4-methoxyphenyl)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-methoxyphenyl)acetamide
2-(4-benzyl-1,5-dioxo-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-2(1H)-yl)-N-(4-methoxyphenyl)acetamide
Compound characteristics
| Compound ID: | F365-0132 |
| Compound Name: | 2-(4-benzyl-1,5-dioxo-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-2(1H)-yl)-N-(4-methoxyphenyl)acetamide |
| Molecular Weight: | 455.47 |
| Molecular Formula: | C25 H21 N5 O4 |
| Smiles: | COc1ccc(cc1)NC(CN1C(N2C(=N1)N(Cc1ccccc1)C(c1ccccc12)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5901 |
| logD: | 3.59 |
| logSw: | -3.9019 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.628 |
| InChI Key: | NBWPSOXMPHSSFB-UHFFFAOYSA-N |