4-({2-fluoro-N-[(furan-2-yl)methyl]benzamido}methyl)phenyl ethanesulfonate
Chemical Structure Depiction of
4-({2-fluoro-N-[(furan-2-yl)methyl]benzamido}methyl)phenyl ethanesulfonate
4-({2-fluoro-N-[(furan-2-yl)methyl]benzamido}methyl)phenyl ethanesulfonate
Compound characteristics
| Compound ID: | V030-1110 |
| Compound Name: | 4-({2-fluoro-N-[(furan-2-yl)methyl]benzamido}methyl)phenyl ethanesulfonate |
| Molecular Weight: | 417.45 |
| Molecular Formula: | C21 H20 F N O5 S |
| Smiles: | CCS(=O)(=O)Oc1ccc(CN(Cc2ccco2)C(c2ccccc2F)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.3234 |
| logD: | 3.3234 |
| logSw: | -3.7462 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 59.035 |
| InChI Key: | ZRUHRKFHSCIKIJ-UHFFFAOYSA-N |