4-chloro-2-({[(4-fluorophenyl)methyl](furan-2-carbonyl)amino}methyl)phenyl 4-acetamidobenzene-1-sulfonate
Chemical Structure Depiction of
4-chloro-2-({[(4-fluorophenyl)methyl](furan-2-carbonyl)amino}methyl)phenyl 4-acetamidobenzene-1-sulfonate
4-chloro-2-({[(4-fluorophenyl)methyl](furan-2-carbonyl)amino}methyl)phenyl 4-acetamidobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V026-0200 |
| Compound Name: | 4-chloro-2-({[(4-fluorophenyl)methyl](furan-2-carbonyl)amino}methyl)phenyl 4-acetamidobenzene-1-sulfonate |
| Molecular Weight: | 557 |
| Molecular Formula: | C27 H22 Cl F N2 O6 S |
| Smiles: | CC(Nc1ccc(cc1)S(=O)(=O)Oc1ccc(cc1CN(Cc1ccc(cc1)F)C(c1ccco1)=O)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.4484 |
| logD: | 4.4482 |
| logSw: | -4.6089 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.866 |
| InChI Key: | IHUXOJVXNVTDOE-UHFFFAOYSA-N |