rel-(1R,4R)-1-[4-(2-fluorophenyl)piperazine-1-carbonyl]-4,7,7-trimethyl-2-oxabicyclo[2.2.1]heptan-3-one
Chemical Structure Depiction of
rel-(1R,4R)-1-[4-(2-fluorophenyl)piperazine-1-carbonyl]-4,7,7-trimethyl-2-oxabicyclo[2.2.1]heptan-3-one
rel-(1R,4R)-1-[4-(2-fluorophenyl)piperazine-1-carbonyl]-4,7,7-trimethyl-2-oxabicyclo[2.2.1]heptan-3-one
Compound characteristics
| Compound ID: | 8017-1317 |
| Compound Name: | rel-(1R,4R)-1-[4-(2-fluorophenyl)piperazine-1-carbonyl]-4,7,7-trimethyl-2-oxabicyclo[2.2.1]heptan-3-one |
| Molecular Weight: | 360.43 |
| Molecular Formula: | C20 H25 F N2 O3 |
| Smiles: | CC1(C)[C@]2(C)CC[C@]1(C(N1CCN(CC1)c1ccccc1F)=O)OC2=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.9457 |
| logD: | 2.9457 |
| logSw: | -3.355 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 41.249 |
| InChI Key: | DWOIYLJKOVQZHN-WOJBJXKFSA-N |