3-{[3-fluoro-N-(2-methylpropyl)benzamido]methyl}phenyl 4-fluorobenzene-1-sulfonate
Chemical Structure Depiction of
3-{[3-fluoro-N-(2-methylpropyl)benzamido]methyl}phenyl 4-fluorobenzene-1-sulfonate
3-{[3-fluoro-N-(2-methylpropyl)benzamido]methyl}phenyl 4-fluorobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V017-5171 |
| Compound Name: | 3-{[3-fluoro-N-(2-methylpropyl)benzamido]methyl}phenyl 4-fluorobenzene-1-sulfonate |
| Molecular Weight: | 459.51 |
| Molecular Formula: | C24 H23 F2 N O4 S |
| Smiles: | CC(C)CN(Cc1cccc(c1)OS(c1ccc(cc1)F)(=O)=O)C(c1cccc(c1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9701 |
| logD: | 4.9701 |
| logSw: | -4.7553 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 52.211 |
| InChI Key: | PSJZJVFMUOTFHT-UHFFFAOYSA-N |