3-({(2-ethoxyphenyl)-N-[(furan-2-yl)methyl]carbamamido}methyl)phenyl 4-fluorobenzene-1-sulfonate
Chemical Structure Depiction of
3-({(2-ethoxyphenyl)-N-[(furan-2-yl)methyl]carbamamido}methyl)phenyl 4-fluorobenzene-1-sulfonate
3-({(2-ethoxyphenyl)-N-[(furan-2-yl)methyl]carbamamido}methyl)phenyl 4-fluorobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V028-0192 |
| Compound Name: | 3-({(2-ethoxyphenyl)-N-[(furan-2-yl)methyl]carbamamido}methyl)phenyl 4-fluorobenzene-1-sulfonate |
| Molecular Weight: | 524.57 |
| Molecular Formula: | C27 H25 F N2 O6 S |
| Smiles: | CCOc1ccccc1NC(N(Cc1cccc(c1)OS(c1ccc(cc1)F)(=O)=O)Cc1ccco1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.5691 |
| logD: | 5.5691 |
| logSw: | -5.3897 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.021 |
| InChI Key: | COUXQHXMOFKSJF-UHFFFAOYSA-N |