2-{[3-fluoro-N-(propan-2-yl)benzamido]methyl}phenyl ethanesulfonate
Chemical Structure Depiction of
2-{[3-fluoro-N-(propan-2-yl)benzamido]methyl}phenyl ethanesulfonate
2-{[3-fluoro-N-(propan-2-yl)benzamido]methyl}phenyl ethanesulfonate
Compound characteristics
| Compound ID: | V026-5810 |
| Compound Name: | 2-{[3-fluoro-N-(propan-2-yl)benzamido]methyl}phenyl ethanesulfonate |
| Molecular Weight: | 379.45 |
| Molecular Formula: | C19 H22 F N O4 S |
| Smiles: | CCS(=O)(=O)Oc1ccccc1CN(C(C)C)C(c1cccc(c1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6361 |
| logD: | 3.6361 |
| logSw: | -3.8151 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 51.389 |
| InChI Key: | OLEXUFKWOLZLNE-UHFFFAOYSA-N |