N-{rel-(1R,4R,6S)-2-[(2-chloro-4-methoxyphenyl)acetyl]-2-azabicyclo[2.2.1]heptan-6-yl}benzamide
Chemical Structure Depiction of
N-{rel-(1R,4R,6S)-2-[(2-chloro-4-methoxyphenyl)acetyl]-2-azabicyclo[2.2.1]heptan-6-yl}benzamide
N-{rel-(1R,4R,6S)-2-[(2-chloro-4-methoxyphenyl)acetyl]-2-azabicyclo[2.2.1]heptan-6-yl}benzamide
Compound characteristics
| Compound ID: | S032-1011 |
| Compound Name: | N-{rel-(1R,4R,6S)-2-[(2-chloro-4-methoxyphenyl)acetyl]-2-azabicyclo[2.2.1]heptan-6-yl}benzamide |
| Molecular Weight: | 398.89 |
| Molecular Formula: | C22 H23 Cl N2 O3 |
| Smiles: | COc1ccc(CC(N2C[C@@H]3C[C@@H]([C@H]2C3)NC(c2ccccc2)=O)=O)c(c1)[Cl] |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 3.8196 |
| logD: | 3.8196 |
| logSw: | -4.3949 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.115 |
| InChI Key: | WTLHUYDUQOAUMI-KPOBHBOGSA-N |