2-({acetyl[(4-fluorophenyl)methyl]amino}methyl)phenyl 4-fluorobenzene-1-sulfonate
Chemical Structure Depiction of
2-({acetyl[(4-fluorophenyl)methyl]amino}methyl)phenyl 4-fluorobenzene-1-sulfonate
2-({acetyl[(4-fluorophenyl)methyl]amino}methyl)phenyl 4-fluorobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V029-4803 |
| Compound Name: | 2-({acetyl[(4-fluorophenyl)methyl]amino}methyl)phenyl 4-fluorobenzene-1-sulfonate |
| Molecular Weight: | 431.46 |
| Molecular Formula: | C22 H19 F2 N O4 S |
| Smiles: | CC(N(Cc1ccc(cc1)F)Cc1ccccc1OS(c1ccc(cc1)F)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0076 |
| logD: | 4.0076 |
| logSw: | -4.1245 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 52.765 |
| InChI Key: | XKYDLKIMTGYPAQ-UHFFFAOYSA-N |