rel-(5R,7S)-7-(2-ethoxyphenyl)-5-(4-fluorophenyl)-4,5,6,7-tetrahydro[1,2,4]triazolo[1,5-a]pyrimidin-2-amine
Chemical Structure Depiction of
rel-(5R,7S)-7-(2-ethoxyphenyl)-5-(4-fluorophenyl)-4,5,6,7-tetrahydro[1,2,4]triazolo[1,5-a]pyrimidin-2-amine
rel-(5R,7S)-7-(2-ethoxyphenyl)-5-(4-fluorophenyl)-4,5,6,7-tetrahydro[1,2,4]triazolo[1,5-a]pyrimidin-2-amine
Compound characteristics
| Compound ID: | 6321-0485 |
| Compound Name: | rel-(5R,7S)-7-(2-ethoxyphenyl)-5-(4-fluorophenyl)-4,5,6,7-tetrahydro[1,2,4]triazolo[1,5-a]pyrimidin-2-amine |
| Molecular Weight: | 353.4 |
| Molecular Formula: | C19 H20 F N5 O |
| Smiles: | CCOc1ccccc1[C@H]1C[C@@H](c2ccc(cc2)F)Nc2nc(N)nn12 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 3.6859 |
| logD: | 3.6162 |
| logSw: | -4.028 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 65.804 |
| InChI Key: | XSWVLLHCMKCQLZ-HZPDHXFCSA-N |