5-({2-fluoro-N-[(furan-2-yl)methyl]benzamido}methyl)-2-methoxyphenyl ethanesulfonate
Chemical Structure Depiction of
5-({2-fluoro-N-[(furan-2-yl)methyl]benzamido}methyl)-2-methoxyphenyl ethanesulfonate
5-({2-fluoro-N-[(furan-2-yl)methyl]benzamido}methyl)-2-methoxyphenyl ethanesulfonate
Compound characteristics
| Compound ID: | V001-0227 |
| Compound Name: | 5-({2-fluoro-N-[(furan-2-yl)methyl]benzamido}methyl)-2-methoxyphenyl ethanesulfonate |
| Molecular Weight: | 447.48 |
| Molecular Formula: | C22 H22 F N O6 S |
| Smiles: | CCS(=O)(=O)Oc1cc(CN(Cc2ccco2)C(c2ccccc2F)=O)ccc1OC |
| Stereo: | ACHIRAL |
| logP: | 3.1447 |
| logD: | 3.1447 |
| logSw: | -3.5071 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 66.752 |
| InChI Key: | CHUDTXJPWORGON-UHFFFAOYSA-N |