1-phenyl-2-{[2-(pyridin-4-yl)[1,2,4]triazolo[1,5-c]quinazolin-5-yl]sulfanyl}ethan-1-one
Chemical Structure Depiction of
1-phenyl-2-{[2-(pyridin-4-yl)[1,2,4]triazolo[1,5-c]quinazolin-5-yl]sulfanyl}ethan-1-one
1-phenyl-2-{[2-(pyridin-4-yl)[1,2,4]triazolo[1,5-c]quinazolin-5-yl]sulfanyl}ethan-1-one
Compound characteristics
| Compound ID: | D718-1080 |
| Compound Name: | 1-phenyl-2-{[2-(pyridin-4-yl)[1,2,4]triazolo[1,5-c]quinazolin-5-yl]sulfanyl}ethan-1-one |
| Molecular Weight: | 397.46 |
| Molecular Formula: | C22 H15 N5 O S |
| Smiles: | C(C(c1ccccc1)=O)Sc1nc2ccccc2c2nc(c3ccncc3)nn12 |
| Stereo: | ACHIRAL |
| logP: | 3.9093 |
| logD: | 3.9083 |
| logSw: | -4.1916 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 52.472 |
| InChI Key: | VSLRLXSNMIWEQW-UHFFFAOYSA-N |