rel-(5R,7S)-7-(2-chlorophenyl)-5-(4-ethylphenyl)-4,5,6,7-tetrahydro[1,2,4]triazolo[1,5-a]pyrimidin-2-amine
Chemical Structure Depiction of
rel-(5R,7S)-7-(2-chlorophenyl)-5-(4-ethylphenyl)-4,5,6,7-tetrahydro[1,2,4]triazolo[1,5-a]pyrimidin-2-amine
rel-(5R,7S)-7-(2-chlorophenyl)-5-(4-ethylphenyl)-4,5,6,7-tetrahydro[1,2,4]triazolo[1,5-a]pyrimidin-2-amine
Compound characteristics
| Compound ID: | 6321-0314 |
| Compound Name: | rel-(5R,7S)-7-(2-chlorophenyl)-5-(4-ethylphenyl)-4,5,6,7-tetrahydro[1,2,4]triazolo[1,5-a]pyrimidin-2-amine |
| Molecular Weight: | 353.85 |
| Molecular Formula: | C19 H20 Cl N5 |
| Smiles: | CCc1ccc(cc1)[C@@H]1C[C@H](c2ccccc2[Cl])n2c(N1)nc(N)n2 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 4.6327 |
| logD: | 4.5459 |
| logSw: | -4.9745 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 58.594 |
| InChI Key: | AEUSJIUBYKSFQI-IRXDYDNUSA-N |