N-[rel-(1R,4R,5R)-2-(3,5-dimethoxybenzoyl)-2-azabicyclo[2.2.1]heptan-5-yl]benzenesulfonamide
Chemical Structure Depiction of
N-[rel-(1R,4R,5R)-2-(3,5-dimethoxybenzoyl)-2-azabicyclo[2.2.1]heptan-5-yl]benzenesulfonamide
N-[rel-(1R,4R,5R)-2-(3,5-dimethoxybenzoyl)-2-azabicyclo[2.2.1]heptan-5-yl]benzenesulfonamide
Compound characteristics
| Compound ID: | S035-0556 |
| Compound Name: | N-[rel-(1R,4R,5R)-2-(3,5-dimethoxybenzoyl)-2-azabicyclo[2.2.1]heptan-5-yl]benzenesulfonamide |
| Molecular Weight: | 416.49 |
| Molecular Formula: | C21 H24 N2 O5 S |
| Smiles: | COc1cc(cc(c1)OC)C(N1C[C@@H]2C[C@H]1C[C@@H]2NS(c1ccccc1)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.9238 |
| logD: | 2.9238 |
| logSw: | -3.6041 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.921 |
| InChI Key: | YFNODFPCCFPASS-FTRWYGJKSA-N |