4-{4-[7-(4-cyclohexylphenyl)[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]piperazine-1-carbonyl}benzonitrile
Chemical Structure Depiction of
4-{4-[7-(4-cyclohexylphenyl)[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]piperazine-1-carbonyl}benzonitrile
4-{4-[7-(4-cyclohexylphenyl)[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]piperazine-1-carbonyl}benzonitrile
Compound characteristics
| Compound ID: | V004-4990 |
| Compound Name: | 4-{4-[7-(4-cyclohexylphenyl)[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]piperazine-1-carbonyl}benzonitrile |
| Molecular Weight: | 491.6 |
| Molecular Formula: | C29 H29 N7 O |
| Salt: | not_available |
| Smiles: | C1CCC(CC1)c1ccc(cc1)c1ccnc2nc(nn12)N1CCN(CC1)C(c1ccc(C#N)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1021 |
| logD: | 5.1021 |
| logSw: | -5.1394 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 66.025 |
| InChI Key: | XHUHDHNKFGFQBW-UHFFFAOYSA-N |