3-{[(butan-2-yl)(diphenylacetyl)amino]methyl}phenyl 4-fluorobenzene-1-sulfonate
Chemical Structure Depiction of
3-{[(butan-2-yl)(diphenylacetyl)amino]methyl}phenyl 4-fluorobenzene-1-sulfonate
3-{[(butan-2-yl)(diphenylacetyl)amino]methyl}phenyl 4-fluorobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V028-0144 |
| Compound Name: | 3-{[(butan-2-yl)(diphenylacetyl)amino]methyl}phenyl 4-fluorobenzene-1-sulfonate |
| Molecular Weight: | 531.65 |
| Molecular Formula: | C31 H30 F N O4 S |
| Smiles: | CCC(C)N(Cc1cccc(c1)OS(c1ccc(cc1)F)(=O)=O)C(C(c1ccccc1)c1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.7478 |
| logD: | 6.7478 |
| logSw: | -5.7086 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 51.268 |
| InChI Key: | ABJKGRIZDRWUTK-QHCPKHFHSA-N |