2-{1-[(3,5-dimethoxyphenyl)methyl]-1H-1,2,3-triazol-4-yl}ethan-1-amine--hydrogen chloride (1/2)
Chemical Structure Depiction of
2-{1-[(3,5-dimethoxyphenyl)methyl]-1H-1,2,3-triazol-4-yl}ethan-1-amine--hydrogen chloride (1/2)
2-{1-[(3,5-dimethoxyphenyl)methyl]-1H-1,2,3-triazol-4-yl}ethan-1-amine--hydrogen chloride (1/2)
Compound characteristics
| Compound ID: | 8020-4315 |
| Compound Name: | 2-{1-[(3,5-dimethoxyphenyl)methyl]-1H-1,2,3-triazol-4-yl}ethan-1-amine--hydrogen chloride (1/2) |
| Molecular Weight: | 335.23 |
| Molecular Formula: | C13 H18 N4 O2 |
| Salt: | 2HCl |
| Smiles: | COc1cc(Cn2cc(CCN)nn2)cc(c1)OC |
| Stereo: | ACHIRAL |
| logP: | 0.6737 |
| logD: | -2.9257 |
| logSw: | -1.0675 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 63.49 |
| InChI Key: | SBXOPIJRYAXVQT-UHFFFAOYSA-N |