[4-({[(3,4-dichlorophenyl)methyl]sulfanyl}methyl)phenyl]{3-[2-(propan-2-yl)phenoxy]-8-azabicyclo[3.2.1]octan-8-yl}methanone
Chemical Structure Depiction of
[4-({[(3,4-dichlorophenyl)methyl]sulfanyl}methyl)phenyl]{3-[2-(propan-2-yl)phenoxy]-8-azabicyclo[3.2.1]octan-8-yl}methanone
[4-({[(3,4-dichlorophenyl)methyl]sulfanyl}methyl)phenyl]{3-[2-(propan-2-yl)phenoxy]-8-azabicyclo[3.2.1]octan-8-yl}methanone
Compound characteristics
| Compound ID: | V008-4515 |
| Compound Name: | [4-({[(3,4-dichlorophenyl)methyl]sulfanyl}methyl)phenyl]{3-[2-(propan-2-yl)phenoxy]-8-azabicyclo[3.2.1]octan-8-yl}methanone |
| Molecular Weight: | 554.58 |
| Molecular Formula: | C31 H33 Cl2 N O2 S |
| Smiles: | [H]C1(CC2CCC(C1)N2C(c1ccc(CSCc2ccc(c(c2)[Cl])[Cl])cc1)=O)Oc1ccccc1C(C)C |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 6.9128 |
| logD: | 6.9128 |
| logSw: | -6.3959 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 21.8354 |
| InChI Key: | QZOOJEROEJMZKC-UHFFFAOYSA-N |