3-{[3-fluoro-N-(2-methoxyethyl)benzamido]methyl}phenyl propane-2-sulfonate
Chemical Structure Depiction of
3-{[3-fluoro-N-(2-methoxyethyl)benzamido]methyl}phenyl propane-2-sulfonate
3-{[3-fluoro-N-(2-methoxyethyl)benzamido]methyl}phenyl propane-2-sulfonate
Compound characteristics
| Compound ID: | V026-4494 |
| Compound Name: | 3-{[3-fluoro-N-(2-methoxyethyl)benzamido]methyl}phenyl propane-2-sulfonate |
| Molecular Weight: | 409.48 |
| Molecular Formula: | C20 H24 F N O5 S |
| Smiles: | CC(C)S(=O)(=O)Oc1cccc(CN(CCOC)C(c2cccc(c2)F)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 2.7462 |
| logD: | 2.7462 |
| logSw: | -3.17 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 60.803 |
| InChI Key: | CYYJDTFVIDXNEF-UHFFFAOYSA-N |