methyl {[2-(pyridin-4-yl)[1,2,4]triazolo[1,5-c]quinazolin-5-yl]sulfanyl}acetate
Chemical Structure Depiction of
methyl {[2-(pyridin-4-yl)[1,2,4]triazolo[1,5-c]quinazolin-5-yl]sulfanyl}acetate
methyl {[2-(pyridin-4-yl)[1,2,4]triazolo[1,5-c]quinazolin-5-yl]sulfanyl}acetate
Compound characteristics
| Compound ID: | D718-1079 |
| Compound Name: | methyl {[2-(pyridin-4-yl)[1,2,4]triazolo[1,5-c]quinazolin-5-yl]sulfanyl}acetate |
| Molecular Weight: | 351.38 |
| Molecular Formula: | C17 H13 N5 O2 S |
| Smiles: | COC(CSc1nc2ccccc2c2nc(c3ccncc3)nn12)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5072 |
| logD: | 2.5058 |
| logSw: | -2.3952 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 60.076 |
| InChI Key: | CBVPBKZBQOPNFW-UHFFFAOYSA-N |