3-[2-(aminomethyl)-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]-N-(3-bromophenyl)propanamide
Chemical Structure Depiction of
3-[2-(aminomethyl)-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]-N-(3-bromophenyl)propanamide
3-[2-(aminomethyl)-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]-N-(3-bromophenyl)propanamide
Compound characteristics
| Compound ID: | C908-0523 |
| Compound Name: | 3-[2-(aminomethyl)-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]-N-(3-bromophenyl)propanamide |
| Molecular Weight: | 439.74 |
| Molecular Formula: | C17 H19 Br N6 O |
| Salt: | HCl |
| Smiles: | Cc1c(CCC(Nc2cccc(c2)[Br])=O)c(C)n2c(n1)nc(CN)n2 |
| Stereo: | ACHIRAL |
| logP: | 1.2184 |
| logD: | -0.4591 |
| logSw: | -2.1135 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 76.905 |
| InChI Key: | BORUYWZSYBVLQX-UHFFFAOYSA-N |