ethyl 4-{[8-(4-{[(4-methyl-1,3-thiazol-2-yl)sulfanyl]methyl}benzoyl)-8-azabicyclo[3.2.1]octan-3-yl]oxy}benzoate
Chemical Structure Depiction of
ethyl 4-{[8-(4-{[(4-methyl-1,3-thiazol-2-yl)sulfanyl]methyl}benzoyl)-8-azabicyclo[3.2.1]octan-3-yl]oxy}benzoate
ethyl 4-{[8-(4-{[(4-methyl-1,3-thiazol-2-yl)sulfanyl]methyl}benzoyl)-8-azabicyclo[3.2.1]octan-3-yl]oxy}benzoate
Compound characteristics
| Compound ID: | V031-2483 |
| Compound Name: | ethyl 4-{[8-(4-{[(4-methyl-1,3-thiazol-2-yl)sulfanyl]methyl}benzoyl)-8-azabicyclo[3.2.1]octan-3-yl]oxy}benzoate |
| Molecular Weight: | 522.69 |
| Molecular Formula: | C28 H30 N2 O4 S2 |
| Salt: | not_available |
| Smiles: | [H]C1(CC2CCC(C1)N2C(c1ccc(CSc2nc(C)cs2)cc1)=O)Oc1ccc(cc1)C(=O)OCC |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.1127 |
| logD: | 4.1126 |
| logSw: | -4.0495 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 51.675 |
| InChI Key: | RPHOMAYLTQMQEO-UHFFFAOYSA-N |