rel-(5R,7R)-2,5-dimethyl-7-phenyl-4,5,6,7-tetrahydro[1,2,4]triazolo[1,5-a]pyrimidine
Chemical Structure Depiction of
rel-(5R,7R)-2,5-dimethyl-7-phenyl-4,5,6,7-tetrahydro[1,2,4]triazolo[1,5-a]pyrimidine
rel-(5R,7R)-2,5-dimethyl-7-phenyl-4,5,6,7-tetrahydro[1,2,4]triazolo[1,5-a]pyrimidine
Compound characteristics
| Compound ID: | Y020-6018 |
| Compound Name: | rel-(5R,7R)-2,5-dimethyl-7-phenyl-4,5,6,7-tetrahydro[1,2,4]triazolo[1,5-a]pyrimidine |
| Molecular Weight: | 228.29 |
| Molecular Formula: | C13 H16 N4 |
| Smiles: | Cc1nc2N[C@H](C)C[C@H](c3ccccc3)n2n1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.411 |
| logD: | 2.4071 |
| logSw: | -2.4337 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 37.511 |
| InChI Key: | DJVKJKTUBCAKLX-SKDRFNHKSA-N |