2-fluoro-N-{[rel-(4aR,7aS)-1-(2-methoxyethyl)-2-oxooctahydro-4aH-cyclopenta[b]pyridin-4a-yl]methyl}benzene-1-sulfonamide
Chemical Structure Depiction of
2-fluoro-N-{[rel-(4aR,7aS)-1-(2-methoxyethyl)-2-oxooctahydro-4aH-cyclopenta[b]pyridin-4a-yl]methyl}benzene-1-sulfonamide
2-fluoro-N-{[rel-(4aR,7aS)-1-(2-methoxyethyl)-2-oxooctahydro-4aH-cyclopenta[b]pyridin-4a-yl]methyl}benzene-1-sulfonamide
Compound characteristics
| Compound ID: | S233-2203 |
| Compound Name: | 2-fluoro-N-{[rel-(4aR,7aS)-1-(2-methoxyethyl)-2-oxooctahydro-4aH-cyclopenta[b]pyridin-4a-yl]methyl}benzene-1-sulfonamide |
| Molecular Weight: | 384.47 |
| Molecular Formula: | C18 H25 F N2 O4 S |
| Smiles: | [H][C@@]12CCC[C@]1(CCC(N2CCOC)=O)CNS(c1ccccc1F)(=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.7518 |
| logD: | 1.7518 |
| logSw: | -2.4174 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.881 |
| InChI Key: | QAOYUZDKJSPNRV-AEFFLSMTSA-N |