5-[(4-methoxyanilino)methyl]-2-({[4-(propan-2-yl)phenyl]methyl}amino)[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Chemical Structure Depiction of
5-[(4-methoxyanilino)methyl]-2-({[4-(propan-2-yl)phenyl]methyl}amino)[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
5-[(4-methoxyanilino)methyl]-2-({[4-(propan-2-yl)phenyl]methyl}amino)[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Compound characteristics
| Compound ID: | D412-0442 |
| Compound Name: | 5-[(4-methoxyanilino)methyl]-2-({[4-(propan-2-yl)phenyl]methyl}amino)[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one |
| Molecular Weight: | 418.5 |
| Molecular Formula: | C23 H26 N6 O2 |
| Smiles: | CC(C)c1ccc(CNc2nc3NC(CNc4ccc(cc4)OC)=CC(n3n2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.0081 |
| logD: | 3.7216 |
| logSw: | -4.2681 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 80.759 |
| InChI Key: | IJDBZROEORXDLK-UHFFFAOYSA-N |