4-chloro-2-{[2-fluoro-N-(2-methylpropyl)benzamido]methyl}phenyl methanesulfonate
Chemical Structure Depiction of
4-chloro-2-{[2-fluoro-N-(2-methylpropyl)benzamido]methyl}phenyl methanesulfonate
4-chloro-2-{[2-fluoro-N-(2-methylpropyl)benzamido]methyl}phenyl methanesulfonate
Compound characteristics
| Compound ID: | V026-6854 |
| Compound Name: | 4-chloro-2-{[2-fluoro-N-(2-methylpropyl)benzamido]methyl}phenyl methanesulfonate |
| Molecular Weight: | 413.89 |
| Molecular Formula: | C19 H21 Cl F N O4 S |
| Smiles: | CC(C)CN(Cc1cc(ccc1OS(C)(=O)=O)[Cl])C(c1ccccc1F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1772 |
| logD: | 4.1772 |
| logSw: | -4.5654 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 52.685 |
| InChI Key: | GVPRXOYOOVCTDI-UHFFFAOYSA-N |