4-[4-(adamantan-1-yl)piperazin-1-yl]-N-methyl-6-(2,2,2-trifluoroethoxy)-1,3,5-triazin-2-amine
Chemical Structure Depiction of
4-[4-(adamantan-1-yl)piperazin-1-yl]-N-methyl-6-(2,2,2-trifluoroethoxy)-1,3,5-triazin-2-amine
4-[4-(adamantan-1-yl)piperazin-1-yl]-N-methyl-6-(2,2,2-trifluoroethoxy)-1,3,5-triazin-2-amine
Compound characteristics
Compound ID: | 8012-4949 |
Compound Name: | 4-[4-(adamantan-1-yl)piperazin-1-yl]-N-methyl-6-(2,2,2-trifluoroethoxy)-1,3,5-triazin-2-amine |
Molecular Weight: | 426.48 |
Molecular Formula: | C20 H29 F3 N6 O |
Smiles: | CNc1nc(nc(n1)OCC(F)(F)F)N1CCN(CC1)C12CC3CC(CC(C3)C2)C1 |
Stereo: | ACHIRAL |
logP: | 5.4243 |
logD: | 5.1796 |
logSw: | -5.4631 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 54.527 |
InChI Key: | LBPFBHWNKHUCPU-UHFFFAOYSA-N |