3-{[N-(2-methoxyethyl)-3-phenylprop-2-enamido]methyl}phenyl 4-fluorobenzene-1-sulfonate
Chemical Structure Depiction of
3-{[N-(2-methoxyethyl)-3-phenylprop-2-enamido]methyl}phenyl 4-fluorobenzene-1-sulfonate
3-{[N-(2-methoxyethyl)-3-phenylprop-2-enamido]methyl}phenyl 4-fluorobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V028-6536 |
| Compound Name: | 3-{[N-(2-methoxyethyl)-3-phenylprop-2-enamido]methyl}phenyl 4-fluorobenzene-1-sulfonate |
| Molecular Weight: | 469.53 |
| Molecular Formula: | C25 H24 F N O5 S |
| Smiles: | COCCN(Cc1cccc(c1)OS(c1ccc(cc1)F)(=O)=O)C(/C=C/c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3242 |
| logD: | 4.3242 |
| logSw: | -4.3448 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 60.004 |
| InChI Key: | FRFCQRIPNWOLLC-UHFFFAOYSA-N |