3-{[N-(2-methoxyethyl)(2-methoxyphenyl)carbamamido]methyl}phenyl 3-fluoro-4-methoxybenzene-1-sulfonate
Chemical Structure Depiction of
3-{[N-(2-methoxyethyl)(2-methoxyphenyl)carbamamido]methyl}phenyl 3-fluoro-4-methoxybenzene-1-sulfonate
3-{[N-(2-methoxyethyl)(2-methoxyphenyl)carbamamido]methyl}phenyl 3-fluoro-4-methoxybenzene-1-sulfonate
Compound characteristics
| Compound ID: | V027-2528 |
| Compound Name: | 3-{[N-(2-methoxyethyl)(2-methoxyphenyl)carbamamido]methyl}phenyl 3-fluoro-4-methoxybenzene-1-sulfonate |
| Molecular Weight: | 518.56 |
| Molecular Formula: | C25 H27 F N2 O7 S |
| Smiles: | COCCN(Cc1cccc(c1)OS(c1ccc(c(c1)F)OC)(=O)=O)C(Nc1ccccc1OC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0686 |
| logD: | 4.0686 |
| logSw: | -4.1151 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.916 |
| InChI Key: | FTKNPVSBWLRESF-UHFFFAOYSA-N |