4-({3-fluoro-N-[(oxolan-2-yl)methyl]benzamido}methyl)phenyl propane-2-sulfonate
Chemical Structure Depiction of
4-({3-fluoro-N-[(oxolan-2-yl)methyl]benzamido}methyl)phenyl propane-2-sulfonate
4-({3-fluoro-N-[(oxolan-2-yl)methyl]benzamido}methyl)phenyl propane-2-sulfonate
Compound characteristics
| Compound ID: | V026-9044 |
| Compound Name: | 4-({3-fluoro-N-[(oxolan-2-yl)methyl]benzamido}methyl)phenyl propane-2-sulfonate |
| Molecular Weight: | 435.51 |
| Molecular Formula: | C22 H26 F N O5 S |
| Smiles: | CC(C)S(=O)(=O)Oc1ccc(CN(CC2CCCO2)C(c2cccc(c2)F)=O)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8828 |
| logD: | 2.8828 |
| logSw: | -3.3415 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 60.865 |
| InChI Key: | QOIYJYRWFVSASC-OAQYLSRUSA-N |