(2-ethoxyphenyl)[rel-(1R,6S)-8-(methanesulfonyl)-3,8-diazabicyclo[4.2.0]octan-3-yl]methanone
Chemical Structure Depiction of
(2-ethoxyphenyl)[rel-(1R,6S)-8-(methanesulfonyl)-3,8-diazabicyclo[4.2.0]octan-3-yl]methanone
(2-ethoxyphenyl)[rel-(1R,6S)-8-(methanesulfonyl)-3,8-diazabicyclo[4.2.0]octan-3-yl]methanone
Compound characteristics
| Compound ID: | S616-1270 |
| Compound Name: | (2-ethoxyphenyl)[rel-(1R,6S)-8-(methanesulfonyl)-3,8-diazabicyclo[4.2.0]octan-3-yl]methanone |
| Molecular Weight: | 338.42 |
| Molecular Formula: | C16 H22 N2 O4 S |
| Smiles: | CCOc1ccccc1C(N1CC[C@@H]2CN([C@@H]2C1)S(C)(=O)=O)=O |
| Stereo: | RELATIVE |
| logP: | 1.1791 |
| logD: | 1.1791 |
| logSw: | -2.3499 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 55.565 |
| InChI Key: | WJGHASGKLWNSTN-OCCSQVGLSA-N |