ethyl 4-{[8-(4-{[(4-methoxyphenyl)sulfanyl]methyl}benzoyl)-8-azabicyclo[3.2.1]octan-3-yl]oxy}benzoate
Chemical Structure Depiction of
ethyl 4-{[8-(4-{[(4-methoxyphenyl)sulfanyl]methyl}benzoyl)-8-azabicyclo[3.2.1]octan-3-yl]oxy}benzoate
ethyl 4-{[8-(4-{[(4-methoxyphenyl)sulfanyl]methyl}benzoyl)-8-azabicyclo[3.2.1]octan-3-yl]oxy}benzoate
Compound characteristics
| Compound ID: | V004-5443 |
| Compound Name: | ethyl 4-{[8-(4-{[(4-methoxyphenyl)sulfanyl]methyl}benzoyl)-8-azabicyclo[3.2.1]octan-3-yl]oxy}benzoate |
| Molecular Weight: | 531.67 |
| Molecular Formula: | C31 H33 N O5 S |
| Smiles: | [H]C1(CC2CCC(C1)N2C(c1ccc(CSc2ccc(cc2)OC)cc1)=O)Oc1ccc(cc1)C(=O)OCC |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.5569 |
| logD: | 4.5569 |
| logSw: | -4.3293 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 50.046 |
| InChI Key: | DUUMOLNWTBAALE-UHFFFAOYSA-N |