rel-(5R,7S)-7-(2,6-dichlorophenyl)-5-(4-ethoxyphenyl)-4,5,6,7-tetrahydro[1,2,4]triazolo[1,5-a]pyrimidin-2-amine
Chemical Structure Depiction of
rel-(5R,7S)-7-(2,6-dichlorophenyl)-5-(4-ethoxyphenyl)-4,5,6,7-tetrahydro[1,2,4]triazolo[1,5-a]pyrimidin-2-amine
rel-(5R,7S)-7-(2,6-dichlorophenyl)-5-(4-ethoxyphenyl)-4,5,6,7-tetrahydro[1,2,4]triazolo[1,5-a]pyrimidin-2-amine
Compound characteristics
| Compound ID: | 6321-0399 |
| Compound Name: | rel-(5R,7S)-7-(2,6-dichlorophenyl)-5-(4-ethoxyphenyl)-4,5,6,7-tetrahydro[1,2,4]triazolo[1,5-a]pyrimidin-2-amine |
| Molecular Weight: | 404.3 |
| Molecular Formula: | C19 H19 Cl2 N5 O |
| Smiles: | CCOc1ccc(cc1)[C@@H]1C[C@H](c2c(cccc2[Cl])[Cl])n2c(N1)nc(N)n2 |
| Stereo: | RELATIVE |
| logP: | 3.9917 |
| logD: | 3.9049 |
| logSw: | -4.4039 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 65.718 |
| InChI Key: | NXGPFFHFQKGHBH-HOTGVXAUSA-N |