3-{[(4-methoxy-3,5-dimethylpyridin-2-yl)methyl]sulfanyl}-5-phenyl[1,2,4]triazolo[4,3-c]quinazoline
Chemical Structure Depiction of
3-{[(4-methoxy-3,5-dimethylpyridin-2-yl)methyl]sulfanyl}-5-phenyl[1,2,4]triazolo[4,3-c]quinazoline
3-{[(4-methoxy-3,5-dimethylpyridin-2-yl)methyl]sulfanyl}-5-phenyl[1,2,4]triazolo[4,3-c]quinazoline
Compound characteristics
| Compound ID: | J084-0202 |
| Compound Name: | 3-{[(4-methoxy-3,5-dimethylpyridin-2-yl)methyl]sulfanyl}-5-phenyl[1,2,4]triazolo[4,3-c]quinazoline |
| Molecular Weight: | 427.53 |
| Molecular Formula: | C24 H21 N5 O S |
| Smiles: | Cc1cnc(CSc2nnc3c4ccccc4nc(c4ccccc4)n23)c(C)c1OC |
| Stereo: | ACHIRAL |
| logP: | 5.1567 |
| logD: | 5.0385 |
| logSw: | -5.2372 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 48.43 |
| InChI Key: | JICCOSILEGBQHS-UHFFFAOYSA-N |