N-{rel-(1R,4R,5R)-2-[4-(trifluoromethoxy)benzoyl]-2-azabicyclo[2.2.1]heptan-5-yl}thiophene-2-sulfonamide
Chemical Structure Depiction of
N-{rel-(1R,4R,5R)-2-[4-(trifluoromethoxy)benzoyl]-2-azabicyclo[2.2.1]heptan-5-yl}thiophene-2-sulfonamide
N-{rel-(1R,4R,5R)-2-[4-(trifluoromethoxy)benzoyl]-2-azabicyclo[2.2.1]heptan-5-yl}thiophene-2-sulfonamide
Compound characteristics
| Compound ID: | S035-1250 |
| Compound Name: | N-{rel-(1R,4R,5R)-2-[4-(trifluoromethoxy)benzoyl]-2-azabicyclo[2.2.1]heptan-5-yl}thiophene-2-sulfonamide |
| Molecular Weight: | 446.47 |
| Molecular Formula: | C18 H17 F3 N2 O4 S2 |
| Smiles: | C1[C@H]2CN(C(c3ccc(cc3)OC(F)(F)F)=O)[C@@H]1C[C@@H]2NS(c1cccs1)(=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 3.5843 |
| logD: | 3.5841 |
| logSw: | -3.7968 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.788 |
| InChI Key: | MDULRAIQVIOAHD-YDHLFZDLSA-N |