3-{[3-fluoro-N-(2-methylpropyl)benzamido]methyl}phenyl 3-fluoro-4-methoxybenzene-1-sulfonate
Chemical Structure Depiction of
3-{[3-fluoro-N-(2-methylpropyl)benzamido]methyl}phenyl 3-fluoro-4-methoxybenzene-1-sulfonate
3-{[3-fluoro-N-(2-methylpropyl)benzamido]methyl}phenyl 3-fluoro-4-methoxybenzene-1-sulfonate
Compound characteristics
| Compound ID: | V027-9233 |
| Compound Name: | 3-{[3-fluoro-N-(2-methylpropyl)benzamido]methyl}phenyl 3-fluoro-4-methoxybenzene-1-sulfonate |
| Molecular Weight: | 489.54 |
| Molecular Formula: | C25 H25 F2 N O5 S |
| Smiles: | CC(C)CN(Cc1cccc(c1)OS(c1ccc(c(c1)F)OC)(=O)=O)C(c1cccc(c1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8964 |
| logD: | 4.8964 |
| logSw: | -4.7763 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 59.841 |
| InChI Key: | PFWXPKPAUHLGEK-UHFFFAOYSA-N |