[4-({[4-(methylsulfanyl)phenyl]sulfanyl}methyl)phenyl]{3-[2-(propan-2-yl)phenoxy]-8-azabicyclo[3.2.1]octan-8-yl}methanone
Chemical Structure Depiction of
[4-({[4-(methylsulfanyl)phenyl]sulfanyl}methyl)phenyl]{3-[2-(propan-2-yl)phenoxy]-8-azabicyclo[3.2.1]octan-8-yl}methanone
[4-({[4-(methylsulfanyl)phenyl]sulfanyl}methyl)phenyl]{3-[2-(propan-2-yl)phenoxy]-8-azabicyclo[3.2.1]octan-8-yl}methanone
Compound characteristics
| Compound ID: | V006-8433 |
| Compound Name: | [4-({[4-(methylsulfanyl)phenyl]sulfanyl}methyl)phenyl]{3-[2-(propan-2-yl)phenoxy]-8-azabicyclo[3.2.1]octan-8-yl}methanone |
| Molecular Weight: | 517.75 |
| Molecular Formula: | C31 H35 N O2 S2 |
| Smiles: | [H]C1(CC2CCC(C1)N2C(c1ccc(CSc2ccc(cc2)SC)cc1)=O)Oc1ccccc1C(C)C |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.8541 |
| logD: | 5.8541 |
| logSw: | -5.6224 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 21.8354 |
| InChI Key: | VRKUXCVKOOBOJE-UHFFFAOYSA-N |