5-({3-fluoro-N-[(4-fluorophenyl)methyl]benzamido}methyl)-2-methoxyphenyl ethanesulfonate
Chemical Structure Depiction of
5-({3-fluoro-N-[(4-fluorophenyl)methyl]benzamido}methyl)-2-methoxyphenyl ethanesulfonate
5-({3-fluoro-N-[(4-fluorophenyl)methyl]benzamido}methyl)-2-methoxyphenyl ethanesulfonate
Compound characteristics
| Compound ID: | V026-2847 |
| Compound Name: | 5-({3-fluoro-N-[(4-fluorophenyl)methyl]benzamido}methyl)-2-methoxyphenyl ethanesulfonate |
| Molecular Weight: | 475.51 |
| Molecular Formula: | C24 H23 F2 N O5 S |
| Smiles: | CCS(=O)(=O)Oc1cc(CN(Cc2ccc(cc2)F)C(c2cccc(c2)F)=O)ccc1OC |
| Stereo: | ACHIRAL |
| logP: | 3.5465 |
| logD: | 3.5465 |
| logSw: | -3.7644 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 59.004 |
| InChI Key: | NPKMIBDGJOAPOF-UHFFFAOYSA-N |