3-({[(4-fluorophenyl)methyl](furan-2-carbonyl)amino}methyl)phenyl 2-chloro-6-methylbenzene-1-sulfonate
Chemical Structure Depiction of
3-({[(4-fluorophenyl)methyl](furan-2-carbonyl)amino}methyl)phenyl 2-chloro-6-methylbenzene-1-sulfonate
3-({[(4-fluorophenyl)methyl](furan-2-carbonyl)amino}methyl)phenyl 2-chloro-6-methylbenzene-1-sulfonate
Compound characteristics
| Compound ID: | V028-1644 |
| Compound Name: | 3-({[(4-fluorophenyl)methyl](furan-2-carbonyl)amino}methyl)phenyl 2-chloro-6-methylbenzene-1-sulfonate |
| Molecular Weight: | 513.97 |
| Molecular Formula: | C26 H21 Cl F N O5 S |
| Smiles: | Cc1cccc(c1S(=O)(=O)Oc1cccc(CN(Cc2ccc(cc2)F)C(c2ccco2)=O)c1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.0631 |
| logD: | 5.0631 |
| logSw: | -5.321 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 60.518 |
| InChI Key: | SKVOCQIPUNKMCV-UHFFFAOYSA-N |