4-({[(4-fluorophenyl)methyl](methoxyacetyl)amino}methyl)phenyl propane-2-sulfonate
Chemical Structure Depiction of
4-({[(4-fluorophenyl)methyl](methoxyacetyl)amino}methyl)phenyl propane-2-sulfonate
4-({[(4-fluorophenyl)methyl](methoxyacetyl)amino}methyl)phenyl propane-2-sulfonate
Compound characteristics
| Compound ID: | V029-9696 |
| Compound Name: | 4-({[(4-fluorophenyl)methyl](methoxyacetyl)amino}methyl)phenyl propane-2-sulfonate |
| Molecular Weight: | 409.48 |
| Molecular Formula: | C20 H24 F N O5 S |
| Smiles: | CC(C)S(=O)(=O)Oc1ccc(CN(Cc2ccc(cc2)F)C(COC)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 2.3501 |
| logD: | 2.3501 |
| logSw: | -2.6616 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 60.379 |
| InChI Key: | FGJFSGGJPZGDDH-UHFFFAOYSA-N |