2-(adamantan-1-yl)-7-[4-(2,5-dimethylphenyl)piperazin-1-yl]-5-methyl[1,2,4]triazolo[1,5-a]pyrimidine
Chemical Structure Depiction of
2-(adamantan-1-yl)-7-[4-(2,5-dimethylphenyl)piperazin-1-yl]-5-methyl[1,2,4]triazolo[1,5-a]pyrimidine
2-(adamantan-1-yl)-7-[4-(2,5-dimethylphenyl)piperazin-1-yl]-5-methyl[1,2,4]triazolo[1,5-a]pyrimidine
Compound characteristics
| Compound ID: | C301-7386 |
| Compound Name: | 2-(adamantan-1-yl)-7-[4-(2,5-dimethylphenyl)piperazin-1-yl]-5-methyl[1,2,4]triazolo[1,5-a]pyrimidine |
| Molecular Weight: | 456.63 |
| Molecular Formula: | C28 H36 N6 |
| Smiles: | Cc1ccc(C)c(c1)N1CCN(CC1)c1cc(C)nc2nc(C34CC5CC(CC(C5)C4)C3)nn12 |
| Stereo: | ACHIRAL |
| logP: | 7.0299 |
| logD: | 6.7325 |
| logSw: | -5.8084 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 36.11 |
| InChI Key: | YTQGAUPNJHKBHY-UHFFFAOYSA-N |