2-({[4-(propan-2-yl)phenyl]methyl}amino)-5-propyl[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Chemical Structure Depiction of
2-({[4-(propan-2-yl)phenyl]methyl}amino)-5-propyl[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
2-({[4-(propan-2-yl)phenyl]methyl}amino)-5-propyl[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Compound characteristics
| Compound ID: | D043-0187 |
| Compound Name: | 2-({[4-(propan-2-yl)phenyl]methyl}amino)-5-propyl[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one |
| Molecular Weight: | 325.41 |
| Molecular Formula: | C18 H23 N5 O |
| Smiles: | CCCC1=CC(n2c(N1)nc(NCc1ccc(cc1)C(C)C)n2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.742 |
| logD: | 3.3432 |
| logSw: | -3.9073 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 62.981 |
| InChI Key: | OFIPHJYXRLQHPZ-UHFFFAOYSA-N |