rel-(1R,4S,6S)-6-[(benzenesulfonyl)amino]-N-[(4-methoxyphenyl)methyl]-2-azabicyclo[2.2.1]heptane-2-carboxamide
Chemical Structure Depiction of
rel-(1R,4S,6S)-6-[(benzenesulfonyl)amino]-N-[(4-methoxyphenyl)methyl]-2-azabicyclo[2.2.1]heptane-2-carboxamide
rel-(1R,4S,6S)-6-[(benzenesulfonyl)amino]-N-[(4-methoxyphenyl)methyl]-2-azabicyclo[2.2.1]heptane-2-carboxamide
Compound characteristics
| Compound ID: | S033-0718 |
| Compound Name: | rel-(1R,4S,6S)-6-[(benzenesulfonyl)amino]-N-[(4-methoxyphenyl)methyl]-2-azabicyclo[2.2.1]heptane-2-carboxamide |
| Molecular Weight: | 415.51 |
| Molecular Formula: | C21 H25 N3 O4 S |
| Smiles: | COc1ccc(CNC(N2C[C@@H]3C[C@@H]([C@H]2C3)NS(c2ccccc2)(=O)=O)=O)cc1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.8559 |
| logD: | 2.8559 |
| logSw: | -3.6056 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.344 |
| InChI Key: | AYILZSOLCPRFAV-DBVUQKKJSA-N |