2-{[(3,4-dimethoxyphenyl)methyl]amino}-5-[(2,6-dimethylanilino)methyl][1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Chemical Structure Depiction of
2-{[(3,4-dimethoxyphenyl)methyl]amino}-5-[(2,6-dimethylanilino)methyl][1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
2-{[(3,4-dimethoxyphenyl)methyl]amino}-5-[(2,6-dimethylanilino)methyl][1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Compound characteristics
| Compound ID: | D412-0385 |
| Compound Name: | 2-{[(3,4-dimethoxyphenyl)methyl]amino}-5-[(2,6-dimethylanilino)methyl][1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one |
| Molecular Weight: | 434.5 |
| Molecular Formula: | C23 H26 N6 O3 |
| Smiles: | Cc1cccc(C)c1NCC1=CC(n2c(N1)nc(NCc1ccc(c(c1)OC)OC)n2)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5904 |
| logD: | 2.3045 |
| logSw: | -2.7898 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 87.081 |
| InChI Key: | YGNJDLZLDMOZMP-UHFFFAOYSA-N |