ethyl 4-({[(4-fluorophenyl)methyl](4-nitrobenzene-1-sulfonyl)amino}methyl)benzoate
Chemical Structure Depiction of
ethyl 4-({[(4-fluorophenyl)methyl](4-nitrobenzene-1-sulfonyl)amino}methyl)benzoate
ethyl 4-({[(4-fluorophenyl)methyl](4-nitrobenzene-1-sulfonyl)amino}methyl)benzoate
Compound characteristics
| Compound ID: | K783-3611 |
| Compound Name: | ethyl 4-({[(4-fluorophenyl)methyl](4-nitrobenzene-1-sulfonyl)amino}methyl)benzoate |
| Molecular Weight: | 472.49 |
| Molecular Formula: | C23 H21 F N2 O6 S |
| Smiles: | CCOC(c1ccc(CN(Cc2ccc(cc2)F)S(c2ccc(cc2)[N+]([O-])=O)(=O)=O)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1635 |
| logD: | 5.1635 |
| logSw: | -5.0269 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 85.478 |
| InChI Key: | OSALGXGBEHSYMB-UHFFFAOYSA-N |