1-(3,4-dimethoxyphenyl)-2-[(2-methyl[1,2,4]triazolo[1,5-c]quinazolin-5-yl)sulfanyl]ethan-1-one
Chemical Structure Depiction of
1-(3,4-dimethoxyphenyl)-2-[(2-methyl[1,2,4]triazolo[1,5-c]quinazolin-5-yl)sulfanyl]ethan-1-one
1-(3,4-dimethoxyphenyl)-2-[(2-methyl[1,2,4]triazolo[1,5-c]quinazolin-5-yl)sulfanyl]ethan-1-one
Compound characteristics
| Compound ID: | D718-1096 |
| Compound Name: | 1-(3,4-dimethoxyphenyl)-2-[(2-methyl[1,2,4]triazolo[1,5-c]quinazolin-5-yl)sulfanyl]ethan-1-one |
| Molecular Weight: | 394.45 |
| Molecular Formula: | C20 H18 N4 O3 S |
| Smiles: | Cc1nc2c3ccccc3nc(n2n1)SCC(c1ccc(c(c1)OC)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1989 |
| logD: | 3.1831 |
| logSw: | -3.2891 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 58.189 |
| InChI Key: | FLLVFLRZZOWQRM-UHFFFAOYSA-N |