2-{[3-fluoro-N-(propan-2-yl)benzamido]methyl}phenyl propane-2-sulfonate
Chemical Structure Depiction of
2-{[3-fluoro-N-(propan-2-yl)benzamido]methyl}phenyl propane-2-sulfonate
2-{[3-fluoro-N-(propan-2-yl)benzamido]methyl}phenyl propane-2-sulfonate
Compound characteristics
| Compound ID: | V026-9936 |
| Compound Name: | 2-{[3-fluoro-N-(propan-2-yl)benzamido]methyl}phenyl propane-2-sulfonate |
| Molecular Weight: | 393.48 |
| Molecular Formula: | C20 H24 F N O4 S |
| Smiles: | CC(C)N(Cc1ccccc1OS(C(C)C)(=O)=O)C(c1cccc(c1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1031 |
| logD: | 4.1031 |
| logSw: | -4.2913 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 52.313 |
| InChI Key: | OYINZHYEOHHVDW-UHFFFAOYSA-N |