ethyl {[5-(4-methylphenyl)[1,2,4]triazolo[4,3-c]quinazolin-3-yl]sulfanyl}acetate
Chemical Structure Depiction of
ethyl {[5-(4-methylphenyl)[1,2,4]triazolo[4,3-c]quinazolin-3-yl]sulfanyl}acetate
ethyl {[5-(4-methylphenyl)[1,2,4]triazolo[4,3-c]quinazolin-3-yl]sulfanyl}acetate
Compound characteristics
| Compound ID: | J084-0816 |
| Compound Name: | ethyl {[5-(4-methylphenyl)[1,2,4]triazolo[4,3-c]quinazolin-3-yl]sulfanyl}acetate |
| Molecular Weight: | 378.45 |
| Molecular Formula: | C20 H18 N4 O2 S |
| Smiles: | CCOC(CSc1nnc2c3ccccc3nc(c3ccc(C)cc3)n12)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4947 |
| logD: | 4.4655 |
| logSw: | -4.2438 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 50.741 |
| InChI Key: | BTSQMIKPNHFQJE-UHFFFAOYSA-N |