2-(4-tert-butylphenyl)-5-[(2,3-dimethylanilino)methyl][1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Chemical Structure Depiction of
2-(4-tert-butylphenyl)-5-[(2,3-dimethylanilino)methyl][1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
2-(4-tert-butylphenyl)-5-[(2,3-dimethylanilino)methyl][1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Compound characteristics
| Compound ID: | D351-0321 |
| Compound Name: | 2-(4-tert-butylphenyl)-5-[(2,3-dimethylanilino)methyl][1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one |
| Molecular Weight: | 401.51 |
| Molecular Formula: | C24 H27 N5 O |
| Smiles: | Cc1cccc(c1C)NCC1=CC(n2c(N1)nc(c1ccc(cc1)C(C)(C)C)n2)=O |
| Stereo: | ACHIRAL |
| logP: | 5.9342 |
| logD: | 5.7311 |
| logSw: | -5.5952 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 60.877 |
| InChI Key: | HIOIOAOJVPUBDT-UHFFFAOYSA-N |