3-{[(chloroacetyl)(2-methoxyethyl)amino]methyl}phenyl 4-fluorobenzene-1-sulfonate
Chemical Structure Depiction of
3-{[(chloroacetyl)(2-methoxyethyl)amino]methyl}phenyl 4-fluorobenzene-1-sulfonate
3-{[(chloroacetyl)(2-methoxyethyl)amino]methyl}phenyl 4-fluorobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V028-4281 |
| Compound Name: | 3-{[(chloroacetyl)(2-methoxyethyl)amino]methyl}phenyl 4-fluorobenzene-1-sulfonate |
| Molecular Weight: | 415.87 |
| Molecular Formula: | C18 H19 Cl F N O5 S |
| Smiles: | COCCN(Cc1cccc(c1)OS(c1ccc(cc1)F)(=O)=O)C(C[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 2.5327 |
| logD: | 2.5327 |
| logSw: | -2.8646 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 60.276 |
| InChI Key: | VONTUDRWVNXUBU-UHFFFAOYSA-N |