2-{[(4-chlorophenyl)methyl]amino}-5-[(4-methylpiperidin-1-yl)methyl][1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Chemical Structure Depiction of
2-{[(4-chlorophenyl)methyl]amino}-5-[(4-methylpiperidin-1-yl)methyl][1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
2-{[(4-chlorophenyl)methyl]amino}-5-[(4-methylpiperidin-1-yl)methyl][1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Compound characteristics
| Compound ID: | D412-0059 |
| Compound Name: | 2-{[(4-chlorophenyl)methyl]amino}-5-[(4-methylpiperidin-1-yl)methyl][1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one |
| Molecular Weight: | 386.88 |
| Molecular Formula: | C19 H23 Cl N6 O |
| Smiles: | CC1CCN(CC1)CC1=CC(n2c(N1)nc(NCc1ccc(cc1)[Cl])n2)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7912 |
| logD: | 2.7912 |
| logSw: | -3.546 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.713 |
| InChI Key: | CJCROFGTOCVTHD-UHFFFAOYSA-N |