rel-(5R,7S)-5-(2-chlorophenyl)-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-(2-chlorophenyl)-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-(2-chlorophenyl)-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: | 6321-0542 |
| Compound Name: | rel-(5R,7S)-5-(2-chlorophenyl)-7-[4-(propan-2-yl)phenyl]-4,5,6,7-tetrahydro[1,2,4]triazolo[1,5-a]pyrimidin-2-amine |
| Molecular Weight: | 367.88 |
| Molecular Formula: | C20 H22 Cl N5 |
| Smiles: | CC(C)c1ccc(cc1)[C@H]1C[C@@H](c2ccccc2[Cl])Nc2nc(N)nn12 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 4.9262 |
| logD: | 4.8395 |
| logSw: | -5.1431 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 58.594 |
| InChI Key: | JUNVYTSRUJRCGH-QZTJIDSGSA-N |