rel-(5R,7S)-5-(4-ethylphenyl)-7-[4-(propan-2-yl)phenyl]-4,5,6,7-tetrahydro[1,2,4]triazolo[1,5-a]pyrimidin-2-amine
Chemical Structure Depiction of
rel-(5R,7S)-5-(4-ethylphenyl)-7-[4-(propan-2-yl)phenyl]-4,5,6,7-tetrahydro[1,2,4]triazolo[1,5-a]pyrimidin-2-amine
rel-(5R,7S)-5-(4-ethylphenyl)-7-[4-(propan-2-yl)phenyl]-4,5,6,7-tetrahydro[1,2,4]triazolo[1,5-a]pyrimidin-2-amine
Compound characteristics
| Compound ID: | 6321-0549 |
| Compound Name: | rel-(5R,7S)-5-(4-ethylphenyl)-7-[4-(propan-2-yl)phenyl]-4,5,6,7-tetrahydro[1,2,4]triazolo[1,5-a]pyrimidin-2-amine |
| Molecular Weight: | 361.49 |
| Molecular Formula: | C22 H27 N5 |
| Smiles: | CCc1ccc(cc1)[C@@H]1C[C@H](c2ccc(cc2)C(C)C)n2c(N1)nc(N)n2 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.3604 |
| logD: | 5.2737 |
| logSw: | -5.5338 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 58.594 |
| InChI Key: | DABDVISHFGQJMK-PMACEKPBSA-N |