3-{[cyclopropyl(phenoxyacetyl)amino]methyl}phenyl 4-fluorobenzene-1-sulfonate
Chemical Structure Depiction of
3-{[cyclopropyl(phenoxyacetyl)amino]methyl}phenyl 4-fluorobenzene-1-sulfonate
3-{[cyclopropyl(phenoxyacetyl)amino]methyl}phenyl 4-fluorobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V006-5780 |
| Compound Name: | 3-{[cyclopropyl(phenoxyacetyl)amino]methyl}phenyl 4-fluorobenzene-1-sulfonate |
| Molecular Weight: | 455.5 |
| Molecular Formula: | C24 H22 F N O5 S |
| Smiles: | C1CC1N(Cc1cccc(c1)OS(c1ccc(cc1)F)(=O)=O)C(COc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.31 |
| logD: | 4.31 |
| logSw: | -4.4686 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 58.487 |
| InChI Key: | HATOTODPXFYMPG-UHFFFAOYSA-N |