2-(2-methylphenyl)-1-[4-(5-propyl[1,2,4]triazolo[4,3-a]pyrimidin-7-yl)piperazin-1-yl]ethan-1-one
Chemical Structure Depiction of
2-(2-methylphenyl)-1-[4-(5-propyl[1,2,4]triazolo[4,3-a]pyrimidin-7-yl)piperazin-1-yl]ethan-1-one
2-(2-methylphenyl)-1-[4-(5-propyl[1,2,4]triazolo[4,3-a]pyrimidin-7-yl)piperazin-1-yl]ethan-1-one
Compound characteristics
Compound ID: | P664-2014 |
Compound Name: | 2-(2-methylphenyl)-1-[4-(5-propyl[1,2,4]triazolo[4,3-a]pyrimidin-7-yl)piperazin-1-yl]ethan-1-one |
Molecular Weight: | 378.48 |
Molecular Formula: | C21 H26 N6 O |
Smiles: | CCCc1cc(nc2nncn12)N1CCN(CC1)C(Cc1ccccc1C)=O |
Stereo: | ACHIRAL |
logP: | 3.5226 |
logD: | 3.5226 |
logSw: | -3.5436 |
Hydrogen bond acceptors count: | 5 |
Polar surface area: | 50.497 |
InChI Key: | JWQCOYMXXQSPKK-UHFFFAOYSA-N |