2-(3,4-dimethylphenyl)-5-[(2-ethoxyanilino)methyl][1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Chemical Structure Depiction of
2-(3,4-dimethylphenyl)-5-[(2-ethoxyanilino)methyl][1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
2-(3,4-dimethylphenyl)-5-[(2-ethoxyanilino)methyl][1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Compound characteristics
| Compound ID: | D489-0199 |
| Compound Name: | 2-(3,4-dimethylphenyl)-5-[(2-ethoxyanilino)methyl][1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one |
| Molecular Weight: | 389.46 |
| Molecular Formula: | C22 H23 N5 O2 |
| Smiles: | CCOc1ccccc1NCC1=CC(n2c(N1)nc(c1ccc(C)c(C)c1)n2)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5178 |
| logD: | 4.314 |
| logSw: | -4.2977 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.088 |
| InChI Key: | MJTRAGRAFDSYMI-UHFFFAOYSA-N |