ethyl 4-[2-(ethylsulfanyl)-6-oxopyrido[3,4-e][1,2,4]triazolo[1,5-a]pyrimidin-7(6H)-yl]benzoate
Chemical Structure Depiction of
ethyl 4-[2-(ethylsulfanyl)-6-oxopyrido[3,4-e][1,2,4]triazolo[1,5-a]pyrimidin-7(6H)-yl]benzoate
ethyl 4-[2-(ethylsulfanyl)-6-oxopyrido[3,4-e][1,2,4]triazolo[1,5-a]pyrimidin-7(6H)-yl]benzoate
Compound characteristics
| Compound ID: | Y020-3157 |
| Compound Name: | ethyl 4-[2-(ethylsulfanyl)-6-oxopyrido[3,4-e][1,2,4]triazolo[1,5-a]pyrimidin-7(6H)-yl]benzoate |
| Molecular Weight: | 395.44 |
| Molecular Formula: | C19 H17 N5 O3 S |
| Smiles: | CCOC(c1ccc(cc1)N1C=CC2=C(C=Nc3nc(nn23)SCC)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0933 |
| logD: | 3.0933 |
| logSw: | -3.138 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 69.839 |
| InChI Key: | SZXHSRXXMFMRSF-UHFFFAOYSA-N |