[rel-(1R,6S)-8-(methanesulfonyl)-3,8-diazabicyclo[4.2.0]octan-3-yl](6-methoxypyridin-3-yl)methanone
Chemical Structure Depiction of
[rel-(1R,6S)-8-(methanesulfonyl)-3,8-diazabicyclo[4.2.0]octan-3-yl](6-methoxypyridin-3-yl)methanone
[rel-(1R,6S)-8-(methanesulfonyl)-3,8-diazabicyclo[4.2.0]octan-3-yl](6-methoxypyridin-3-yl)methanone
Compound characteristics
| Compound ID: | S616-2189 |
| Compound Name: | [rel-(1R,6S)-8-(methanesulfonyl)-3,8-diazabicyclo[4.2.0]octan-3-yl](6-methoxypyridin-3-yl)methanone |
| Molecular Weight: | 325.38 |
| Molecular Formula: | C14 H19 N3 O4 S |
| Smiles: | COc1ccc(cn1)C(N1CC[C@@H]2CN([C@@H]2C1)S(C)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.3057 |
| logD: | 0.3057 |
| logSw: | -1.9288 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 64.936 |
| InChI Key: | ZOMFTMDCGHUIFL-NEPJUHHUSA-N |