2-[2-(2-chlorophenyl)-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]-1-(2-ethylpiperidin-1-yl)ethan-1-one
Chemical Structure Depiction of
2-[2-(2-chlorophenyl)-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]-1-(2-ethylpiperidin-1-yl)ethan-1-one
2-[2-(2-chlorophenyl)-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]-1-(2-ethylpiperidin-1-yl)ethan-1-one
Compound characteristics
Compound ID: | D458-0183 |
Compound Name: | 2-[2-(2-chlorophenyl)-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]-1-(2-ethylpiperidin-1-yl)ethan-1-one |
Molecular Weight: | 411.93 |
Molecular Formula: | C22 H26 Cl N5 O |
Smiles: | CCC1CCCCN1C(Cc1c(C)nc2nc(c3ccccc3[Cl])nn2c1C)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 3.8618 |
logD: | 3.8617 |
logSw: | -4.3136 |
Hydrogen bond acceptors count: | 5 |
Polar surface area: | 46.871 |
InChI Key: | NOZYQOVPBOMVRD-INIZCTEOSA-N |