3-[2-(aminomethyl)-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]-N-(5-chloro-2,4-dimethoxyphenyl)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-(5-chloro-2,4-dimethoxyphenyl)propanamide--hydrogen chloride (1/1)
3-[2-(aminomethyl)-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]-N-(5-chloro-2,4-dimethoxyphenyl)propanamide--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | C908-0439 |
| Compound Name: | 3-[2-(aminomethyl)-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]-N-(5-chloro-2,4-dimethoxyphenyl)propanamide--hydrogen chloride (1/1) |
| Molecular Weight: | 455.34 |
| Molecular Formula: | C19 H23 Cl N6 O3 |
| Salt: | HCl |
| Smiles: | Cc1c(CCC(Nc2cc(c(cc2OC)OC)[Cl])=O)c(C)n2c(n1)nc(CN)n2 |
| Stereo: | ACHIRAL |
| logP: | 0.7092 |
| logD: | -0.9683 |
| logSw: | -2.5295 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 91.468 |
| InChI Key: | LLAJXBGGAWCXSZ-UHFFFAOYSA-N |