ethyl {[2-(3-nitrophenyl)[1,2,4]triazolo[1,5-c]quinazolin-5-yl]sulfanyl}acetate
Chemical Structure Depiction of
ethyl {[2-(3-nitrophenyl)[1,2,4]triazolo[1,5-c]quinazolin-5-yl]sulfanyl}acetate
ethyl {[2-(3-nitrophenyl)[1,2,4]triazolo[1,5-c]quinazolin-5-yl]sulfanyl}acetate
Compound characteristics
| Compound ID: | K280-0195 |
| Compound Name: | ethyl {[2-(3-nitrophenyl)[1,2,4]triazolo[1,5-c]quinazolin-5-yl]sulfanyl}acetate |
| Molecular Weight: | 409.42 |
| Molecular Formula: | C19 H15 N5 O4 S |
| Smiles: | CCOC(CSc1nc2ccccc2c2nc(c3cccc(c3)[N+]([O-])=O)nn12)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2914 |
| logD: | 4.2901 |
| logSw: | -4.3809 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 83.609 |
| InChI Key: | BLUOJHHIFGEYAK-UHFFFAOYSA-N |