N~1~-[(2-fluorophenyl)methyl]-N~1~,N~4~-bis[(oxolan-2-yl)methyl]benzene-1,4-disulfonamide
Chemical Structure Depiction of
N~1~-[(2-fluorophenyl)methyl]-N~1~,N~4~-bis[(oxolan-2-yl)methyl]benzene-1,4-disulfonamide
N~1~-[(2-fluorophenyl)methyl]-N~1~,N~4~-bis[(oxolan-2-yl)methyl]benzene-1,4-disulfonamide
Compound characteristics
| Compound ID: | D207-0163 |
| Compound Name: | N~1~-[(2-fluorophenyl)methyl]-N~1~,N~4~-bis[(oxolan-2-yl)methyl]benzene-1,4-disulfonamide |
| Molecular Weight: | 512.62 |
| Molecular Formula: | C23 H29 F N2 O6 S2 |
| Smiles: | C1CC(CNS(c2ccc(cc2)S(N(CC2CCCO2)Cc2ccccc2F)(=O)=O)(=O)=O)OC1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.7835 |
| logD: | 2.7834 |
| logSw: | -3.2151 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 90.409 |
| InChI Key: | KHBCZPQKXRVULX-UHFFFAOYSA-N |