ethyl 4-({8-[4-({[(4-chlorophenyl)methyl]sulfanyl}methyl)benzoyl]-8-azabicyclo[3.2.1]octan-3-yl}oxy)benzoate
Chemical Structure Depiction of
ethyl 4-({8-[4-({[(4-chlorophenyl)methyl]sulfanyl}methyl)benzoyl]-8-azabicyclo[3.2.1]octan-3-yl}oxy)benzoate
ethyl 4-({8-[4-({[(4-chlorophenyl)methyl]sulfanyl}methyl)benzoyl]-8-azabicyclo[3.2.1]octan-3-yl}oxy)benzoate
Compound characteristics
| Compound ID: | V008-4561 |
| Compound Name: | ethyl 4-({8-[4-({[(4-chlorophenyl)methyl]sulfanyl}methyl)benzoyl]-8-azabicyclo[3.2.1]octan-3-yl}oxy)benzoate |
| Molecular Weight: | 550.12 |
| Molecular Formula: | C31 H32 Cl N O4 S |
| Smiles: | [H]C1(CC2CCC(C1)N2C(c1ccc(CSCc2ccc(cc2)[Cl])cc1)=O)Oc1ccc(cc1)C(=O)OCC |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.3526 |
| logD: | 5.3526 |
| logSw: | -5.9778 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 42.502 |
| InChI Key: | SKXGHAONUIUQEH-UHFFFAOYSA-N |