2-({4-[4-(adamantan-1-yl)piperazin-1-yl]-6-(2,2,2-trifluoroethoxy)-1,3,5-triazin-2-yl}amino)ethan-1-ol
Chemical Structure Depiction of
2-({4-[4-(adamantan-1-yl)piperazin-1-yl]-6-(2,2,2-trifluoroethoxy)-1,3,5-triazin-2-yl}amino)ethan-1-ol
2-({4-[4-(adamantan-1-yl)piperazin-1-yl]-6-(2,2,2-trifluoroethoxy)-1,3,5-triazin-2-yl}amino)ethan-1-ol
Compound characteristics
| Compound ID: | 8012-5349 |
| Compound Name: | 2-({4-[4-(adamantan-1-yl)piperazin-1-yl]-6-(2,2,2-trifluoroethoxy)-1,3,5-triazin-2-yl}amino)ethan-1-ol |
| Molecular Weight: | 456.51 |
| Molecular Formula: | C21 H31 F3 N6 O2 |
| Smiles: | C1C2CC3CC1CC(C2)(C3)N1CCN(CC1)c1nc(NCCO)nc(n1)OCC(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 4.8848 |
| logD: | 4.6401 |
| logSw: | -4.691 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.874 |
| InChI Key: | BDOVNEMZOFSQOI-UHFFFAOYSA-N |