1-[rel-(1R,6S)-8-(methanesulfonyl)-3,8-diazabicyclo[4.2.0]octan-3-yl]-3-(2-methoxyphenyl)propan-1-one
Chemical Structure Depiction of
1-[rel-(1R,6S)-8-(methanesulfonyl)-3,8-diazabicyclo[4.2.0]octan-3-yl]-3-(2-methoxyphenyl)propan-1-one
1-[rel-(1R,6S)-8-(methanesulfonyl)-3,8-diazabicyclo[4.2.0]octan-3-yl]-3-(2-methoxyphenyl)propan-1-one
Compound characteristics
| Compound ID: | S616-1661 |
| Compound Name: | 1-[rel-(1R,6S)-8-(methanesulfonyl)-3,8-diazabicyclo[4.2.0]octan-3-yl]-3-(2-methoxyphenyl)propan-1-one |
| Molecular Weight: | 352.45 |
| Molecular Formula: | C17 H24 N2 O4 S |
| Smiles: | COc1ccccc1CCC(N1CC[C@@H]2CN([C@@H]2C1)S(C)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.4499 |
| logD: | 1.4499 |
| logSw: | -2.1773 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 55.457 |
| InChI Key: | UDZSLPLQGOALFH-CABCVRRESA-N |