5-methyl-2-{[(4-methylphenyl)methyl]amino}-6-[3-(2-methylpiperidin-1-yl)-3-oxopropyl][1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Chemical Structure Depiction of
5-methyl-2-{[(4-methylphenyl)methyl]amino}-6-[3-(2-methylpiperidin-1-yl)-3-oxopropyl][1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
5-methyl-2-{[(4-methylphenyl)methyl]amino}-6-[3-(2-methylpiperidin-1-yl)-3-oxopropyl][1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Compound characteristics
Compound ID: | D481-0108 |
Compound Name: | 5-methyl-2-{[(4-methylphenyl)methyl]amino}-6-[3-(2-methylpiperidin-1-yl)-3-oxopropyl][1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one |
Molecular Weight: | 422.53 |
Molecular Formula: | C23 H30 N6 O2 |
Smiles: | CC1CCCCN1C(CCC1=C(C)Nc2nc(NCc3ccc(C)cc3)nn2C1=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 2.8793 |
logD: | 2.8361 |
logSw: | -3.2475 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 77.298 |
InChI Key: | DMFUYNBHNAUJJS-INIZCTEOSA-N |