5-({(4-chlorophenyl)-N-[(furan-2-yl)methyl]carbamamido}methyl)-2-methoxyphenyl 4-fluorobenzene-1-sulfonate
Chemical Structure Depiction of
5-({(4-chlorophenyl)-N-[(furan-2-yl)methyl]carbamamido}methyl)-2-methoxyphenyl 4-fluorobenzene-1-sulfonate
5-({(4-chlorophenyl)-N-[(furan-2-yl)methyl]carbamamido}methyl)-2-methoxyphenyl 4-fluorobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V012-1030 |
| Compound Name: | 5-({(4-chlorophenyl)-N-[(furan-2-yl)methyl]carbamamido}methyl)-2-methoxyphenyl 4-fluorobenzene-1-sulfonate |
| Molecular Weight: | 544.99 |
| Molecular Formula: | C26 H22 Cl F N2 O6 S |
| Smiles: | COc1ccc(CN(Cc2ccco2)C(Nc2ccc(cc2)[Cl])=O)cc1OS(c1ccc(cc1)F)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.288 |
| logD: | 5.288 |
| logSw: | -5.8994 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.226 |
| InChI Key: | FYIBFCZRYZHERS-UHFFFAOYSA-N |