N-{rel-(1R,4R,5R)-2-[(3-chloro-4-methoxyphenyl)acetyl]-2-azabicyclo[2.2.1]heptan-5-yl}thiophene-2-sulfonamide
Chemical Structure Depiction of
N-{rel-(1R,4R,5R)-2-[(3-chloro-4-methoxyphenyl)acetyl]-2-azabicyclo[2.2.1]heptan-5-yl}thiophene-2-sulfonamide
N-{rel-(1R,4R,5R)-2-[(3-chloro-4-methoxyphenyl)acetyl]-2-azabicyclo[2.2.1]heptan-5-yl}thiophene-2-sulfonamide
Compound characteristics
| Compound ID: | S035-1332 |
| Compound Name: | N-{rel-(1R,4R,5R)-2-[(3-chloro-4-methoxyphenyl)acetyl]-2-azabicyclo[2.2.1]heptan-5-yl}thiophene-2-sulfonamide |
| Molecular Weight: | 440.97 |
| Molecular Formula: | C19 H21 Cl N2 O4 S2 |
| Smiles: | COc1ccc(CC(N2C[C@@H]3C[C@H]2C[C@@H]3NS(c2cccs2)(=O)=O)=O)cc1[Cl] |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.8746 |
| logD: | 2.8744 |
| logSw: | -3.4736 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.955 |
| InChI Key: | UZNJJWVJNCEYFX-OFQRWUPVSA-N |