4-({4-ethyl-N-[(4-fluorophenyl)methyl]benzamido}methyl)phenyl ethanesulfonate
Chemical Structure Depiction of
4-({4-ethyl-N-[(4-fluorophenyl)methyl]benzamido}methyl)phenyl ethanesulfonate
4-({4-ethyl-N-[(4-fluorophenyl)methyl]benzamido}methyl)phenyl ethanesulfonate
Compound characteristics
| Compound ID: | V012-8794 |
| Compound Name: | 4-({4-ethyl-N-[(4-fluorophenyl)methyl]benzamido}methyl)phenyl ethanesulfonate |
| Molecular Weight: | 455.55 |
| Molecular Formula: | C25 H26 F N O4 S |
| Smiles: | CCc1ccc(cc1)C(N(Cc1ccc(cc1)OS(CC)(=O)=O)Cc1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6171 |
| logD: | 4.6171 |
| logSw: | -4.288 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 51.287 |
| InChI Key: | HRBHLPHNSYARQM-UHFFFAOYSA-N |