3-[2-(aminomethyl)-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]-N-(2,5-diethoxyphenyl)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-(2,5-diethoxyphenyl)propanamide--hydrogen chloride (1/1)
3-[2-(aminomethyl)-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]-N-(2,5-diethoxyphenyl)propanamide--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | C908-0507 |
| Compound Name: | 3-[2-(aminomethyl)-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]-N-(2,5-diethoxyphenyl)propanamide--hydrogen chloride (1/1) |
| Molecular Weight: | 448.95 |
| Molecular Formula: | C21 H28 N6 O3 |
| Salt: | HCl |
| Smiles: | CCOc1ccc(c(c1)NC(CCc1c(C)nc2nc(CN)nn2c1C)=O)OCC |
| Stereo: | ACHIRAL |
| logP: | 0.9028 |
| logD: | -0.7748 |
| logSw: | -2.1397 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 90.541 |
| InChI Key: | QSWACZRWBMPXTF-UHFFFAOYSA-N |