3-(4-chlorophenyl)-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-chlorophenyl)-5-oxo-N-[(pyridin-3-yl)methyl]-4,5-dihydro[1,2,3]triazolo[1,5-a]quinazoline-8-carboxamide
3-(4-chlorophenyl)-5-oxo-N-[(pyridin-3-yl)methyl]-4,5-dihydro[1,2,3]triazolo[1,5-a]quinazoline-8-carboxamide
Compound characteristics
| Compound ID: | E543-0301 |
| Compound Name: | 3-(4-chlorophenyl)-5-oxo-N-[(pyridin-3-yl)methyl]-4,5-dihydro[1,2,3]triazolo[1,5-a]quinazoline-8-carboxamide |
| Molecular Weight: | 430.85 |
| Molecular Formula: | C22 H15 Cl N6 O2 |
| Smiles: | C(c1cccnc1)NC(c1ccc2C(Nc3c(c4ccc(cc4)[Cl])nnn3c2c1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3523 |
| logD: | 2.3521 |
| logSw: | -3.6765 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 84.162 |
| InChI Key: | VFHXIPXQCYQVSP-UHFFFAOYSA-N |