ethyl 2-(benzylsulfanyl)-7-methyl[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
ethyl 2-(benzylsulfanyl)-7-methyl[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
ethyl 2-(benzylsulfanyl)-7-methyl[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
Compound characteristics
Compound ID: | Y020-7897 |
Compound Name: | ethyl 2-(benzylsulfanyl)-7-methyl[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate |
Molecular Weight: | 328.39 |
Molecular Formula: | C16 H16 N4 O2 S |
Smiles: | CCOC(c1cnc2nc(nn2c1C)SCc1ccccc1)=O |
Stereo: | ACHIRAL |
logP: | 2.7134 |
logD: | 2.7134 |
logSw: | -2.93 |
Hydrogen bond acceptors count: | 7 |
Polar surface area: | 50.525 |
InChI Key: | GKFONISULMGIJK-UHFFFAOYSA-N |