3-({N-[(furan-2-yl)methyl](4-methylphenyl)carbamamido}methyl)phenyl 4-fluorobenzene-1-sulfonate
Chemical Structure Depiction of
3-({N-[(furan-2-yl)methyl](4-methylphenyl)carbamamido}methyl)phenyl 4-fluorobenzene-1-sulfonate
3-({N-[(furan-2-yl)methyl](4-methylphenyl)carbamamido}methyl)phenyl 4-fluorobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V011-9099 |
| Compound Name: | 3-({N-[(furan-2-yl)methyl](4-methylphenyl)carbamamido}methyl)phenyl 4-fluorobenzene-1-sulfonate |
| Molecular Weight: | 494.54 |
| Molecular Formula: | C26 H23 F N2 O5 S |
| Smiles: | Cc1ccc(cc1)NC(N(Cc1cccc(c1)OS(c1ccc(cc1)F)(=O)=O)Cc1ccco1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4218 |
| logD: | 5.4218 |
| logSw: | -5.4173 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.509 |
| InChI Key: | JFDBNLWVCUHPRZ-UHFFFAOYSA-N |