4-{[3-fluoro-N-(2-methylpropyl)benzamido]methyl}phenyl 4-acetamidobenzene-1-sulfonate
Chemical Structure Depiction of
4-{[3-fluoro-N-(2-methylpropyl)benzamido]methyl}phenyl 4-acetamidobenzene-1-sulfonate
4-{[3-fluoro-N-(2-methylpropyl)benzamido]methyl}phenyl 4-acetamidobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V024-7946 |
| Compound Name: | 4-{[3-fluoro-N-(2-methylpropyl)benzamido]methyl}phenyl 4-acetamidobenzene-1-sulfonate |
| Molecular Weight: | 498.57 |
| Molecular Formula: | C26 H27 F N2 O5 S |
| Smiles: | CC(C)CN(Cc1ccc(cc1)OS(c1ccc(cc1)NC(C)=O)(=O)=O)C(c1cccc(c1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1002 |
| logD: | 4.1001 |
| logSw: | -4.203 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.473 |
| InChI Key: | ZXZIRHNBFGBNTH-UHFFFAOYSA-N |