ethyl [(8,9-dimethoxy-2-phenyl[1,2,4]triazolo[1,5-c]quinazolin-5-yl)sulfanyl]acetate
Chemical Structure Depiction of
ethyl [(8,9-dimethoxy-2-phenyl[1,2,4]triazolo[1,5-c]quinazolin-5-yl)sulfanyl]acetate
ethyl [(8,9-dimethoxy-2-phenyl[1,2,4]triazolo[1,5-c]quinazolin-5-yl)sulfanyl]acetate
Compound characteristics
| Compound ID: | C445-0092 |
| Compound Name: | ethyl [(8,9-dimethoxy-2-phenyl[1,2,4]triazolo[1,5-c]quinazolin-5-yl)sulfanyl]acetate |
| Molecular Weight: | 424.48 |
| Molecular Formula: | C21 H20 N4 O4 S |
| Smiles: | CCOC(CSc1nc2cc(c(cc2c2nc(c3ccccc3)nn12)OC)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9306 |
| logD: | 3.8307 |
| logSw: | -3.965 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 65.488 |
| InChI Key: | JQVKAXSYDVABJR-UHFFFAOYSA-N |