ethyl {[5-(4-methoxyphenyl)[1,2,4]triazolo[4,3-c]quinazolin-3-yl]sulfanyl}acetate
Chemical Structure Depiction of
ethyl {[5-(4-methoxyphenyl)[1,2,4]triazolo[4,3-c]quinazolin-3-yl]sulfanyl}acetate
ethyl {[5-(4-methoxyphenyl)[1,2,4]triazolo[4,3-c]quinazolin-3-yl]sulfanyl}acetate
Compound characteristics
| Compound ID: | J084-0407 |
| Compound Name: | ethyl {[5-(4-methoxyphenyl)[1,2,4]triazolo[4,3-c]quinazolin-3-yl]sulfanyl}acetate |
| Molecular Weight: | 394.45 |
| Molecular Formula: | C20 H18 N4 O3 S |
| Smiles: | CCOC(CSc1nnc2c3ccccc3nc(c3ccc(cc3)OC)n12)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0537 |
| logD: | 4.0504 |
| logSw: | -4.0962 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 58.284 |
| InChI Key: | AQSJLGAJILJKMF-UHFFFAOYSA-N |