1-(4-{7-hydroxy-3-[(4-methylphenyl)methyl]-3H-[1,2,3]triazolo[4,5-d]pyrimidin-5-yl}piperidin-1-yl)-2-(4-methylphenyl)ethan-1-one
					Chemical Structure Depiction of
1-(4-{7-hydroxy-3-[(4-methylphenyl)methyl]-3H-[1,2,3]triazolo[4,5-d]pyrimidin-5-yl}piperidin-1-yl)-2-(4-methylphenyl)ethan-1-one
			1-(4-{7-hydroxy-3-[(4-methylphenyl)methyl]-3H-[1,2,3]triazolo[4,5-d]pyrimidin-5-yl}piperidin-1-yl)-2-(4-methylphenyl)ethan-1-one
Compound characteristics
| Compound ID: | D327-0155 | 
| Compound Name: | 1-(4-{7-hydroxy-3-[(4-methylphenyl)methyl]-3H-[1,2,3]triazolo[4,5-d]pyrimidin-5-yl}piperidin-1-yl)-2-(4-methylphenyl)ethan-1-one | 
| Molecular Weight: | 456.55 | 
| Molecular Formula: | C26 H28 N6 O2 | 
| Smiles: | Cc1ccc(CC(N2CCC(CC2)c2nc(c3c(n2)n(Cc2ccc(C)cc2)nn3)O)=O)cc1 | 
| Stereo: | ACHIRAL | 
| logP: | 3.4944 | 
| logD: | 3.0403 | 
| logSw: | -3.1463 | 
| Hydrogen bond acceptors count: | 7 | 
| Hydrogen bond donors count: | 1 | 
| Polar surface area: | 78.675 | 
| InChI Key: | VJVCYYWVXKPAHB-UHFFFAOYSA-N | 
 
				 
				