3-({[(4-fluorophenyl)methyl](methoxyacetyl)amino}methyl)phenyl 2-chloro-6-methylbenzene-1-sulfonate
Chemical Structure Depiction of
3-({[(4-fluorophenyl)methyl](methoxyacetyl)amino}methyl)phenyl 2-chloro-6-methylbenzene-1-sulfonate
3-({[(4-fluorophenyl)methyl](methoxyacetyl)amino}methyl)phenyl 2-chloro-6-methylbenzene-1-sulfonate
Compound characteristics
| Compound ID: | V028-1597 |
| Compound Name: | 3-({[(4-fluorophenyl)methyl](methoxyacetyl)amino}methyl)phenyl 2-chloro-6-methylbenzene-1-sulfonate |
| Molecular Weight: | 491.97 |
| Molecular Formula: | C24 H23 Cl F N O5 S |
| Smiles: | Cc1cccc(c1S(=O)(=O)Oc1cccc(CN(Cc2ccc(cc2)F)C(COC)=O)c1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.8428 |
| logD: | 3.8428 |
| logSw: | -4.1132 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 60.107 |
| InChI Key: | BKKAWGHYBGCJGW-UHFFFAOYSA-N |