3-(4-methylphenyl)-5-oxo-N-[(pyridin-3-yl)methyl]-4,5-dihydro[1,2,3]triazolo[1,5-a]quinazoline-8-carboxamide
Chemical Structure Depiction of
3-(4-methylphenyl)-5-oxo-N-[(pyridin-3-yl)methyl]-4,5-dihydro[1,2,3]triazolo[1,5-a]quinazoline-8-carboxamide
3-(4-methylphenyl)-5-oxo-N-[(pyridin-3-yl)methyl]-4,5-dihydro[1,2,3]triazolo[1,5-a]quinazoline-8-carboxamide
Compound characteristics
| Compound ID: | E543-0252 |
| Compound Name: | 3-(4-methylphenyl)-5-oxo-N-[(pyridin-3-yl)methyl]-4,5-dihydro[1,2,3]triazolo[1,5-a]quinazoline-8-carboxamide |
| Molecular Weight: | 410.43 |
| Molecular Formula: | C23 H18 N6 O2 |
| Smiles: | Cc1ccc(cc1)c1c2NC(c3ccc(cc3n2nn1)C(NCc1cccnc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.181 |
| logD: | 2.1808 |
| logSw: | -2.7171 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 84.162 |
| InChI Key: | CDINYLZEUFEKCK-UHFFFAOYSA-N |