2-[(2-ethoxyanilino)methyl]-5-methyl-6-[(4-methylphenyl)methyl][1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Chemical Structure Depiction of
2-[(2-ethoxyanilino)methyl]-5-methyl-6-[(4-methylphenyl)methyl][1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
2-[(2-ethoxyanilino)methyl]-5-methyl-6-[(4-methylphenyl)methyl][1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Compound characteristics
| Compound ID: | D433-1539 |
| Compound Name: | 2-[(2-ethoxyanilino)methyl]-5-methyl-6-[(4-methylphenyl)methyl][1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one |
| Molecular Weight: | 403.48 |
| Molecular Formula: | C23 H25 N5 O2 |
| Smiles: | CCOc1ccccc1NCc1nc2NC(C)=C(Cc3ccc(C)cc3)C(n2n1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0418 |
| logD: | 2.9214 |
| logSw: | -4.051 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.989 |
| InChI Key: | XGUKSLYTWCVZSD-UHFFFAOYSA-N |