3-[2-(aminomethyl)-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]-N-[4-(trifluoromethoxy)phenyl]propanamide--hydrogen chloride (1/1)
Chemical Structure Depiction of
3-[2-(aminomethyl)-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]-N-[4-(trifluoromethoxy)phenyl]propanamide--hydrogen chloride (1/1)
3-[2-(aminomethyl)-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]-N-[4-(trifluoromethoxy)phenyl]propanamide--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | C908-0500 |
| Compound Name: | 3-[2-(aminomethyl)-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]-N-[4-(trifluoromethoxy)phenyl]propanamide--hydrogen chloride (1/1) |
| Molecular Weight: | 444.84 |
| Molecular Formula: | C18 H19 F3 N6 O2 |
| Salt: | HCl |
| Smiles: | Cc1c(CCC(Nc2ccc(cc2)OC(F)(F)F)=O)c(C)n2c(n1)nc(CN)n2 |
| Stereo: | ACHIRAL |
| logP: | 1.6016 |
| logD: | -0.0759 |
| logSw: | -2.0694 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 82.841 |
| InChI Key: | ACIUWLRYZTZNPL-UHFFFAOYSA-N |