N-(4-bromo-3-methylphenyl)-2-[(3-fluorophenyl)methyl]-5,6-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-7-amine
Chemical Structure Depiction of
N-(4-bromo-3-methylphenyl)-2-[(3-fluorophenyl)methyl]-5,6-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-7-amine
N-(4-bromo-3-methylphenyl)-2-[(3-fluorophenyl)methyl]-5,6-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-7-amine
Compound characteristics
| Compound ID: | G652-4531 |
| Compound Name: | N-(4-bromo-3-methylphenyl)-2-[(3-fluorophenyl)methyl]-5,6-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-7-amine |
| Molecular Weight: | 440.32 |
| Molecular Formula: | C21 H19 Br F N5 |
| Smiles: | Cc1cc(ccc1[Br])Nc1c(C)c(C)nc2nc(Cc3cccc(c3)F)nn12 |
| Stereo: | ACHIRAL |
| logP: | 5.5464 |
| logD: | 5.5406 |
| logSw: | -5.6547 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.679 |
| InChI Key: | KHZQHOBOVQBMEX-UHFFFAOYSA-N |