2-{[(butan-2-yl)(methoxyacetyl)amino]methyl}-4-chlorophenyl 4-fluorobenzene-1-sulfonate
Chemical Structure Depiction of
2-{[(butan-2-yl)(methoxyacetyl)amino]methyl}-4-chlorophenyl 4-fluorobenzene-1-sulfonate
2-{[(butan-2-yl)(methoxyacetyl)amino]methyl}-4-chlorophenyl 4-fluorobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V026-0299 |
| Compound Name: | 2-{[(butan-2-yl)(methoxyacetyl)amino]methyl}-4-chlorophenyl 4-fluorobenzene-1-sulfonate |
| Molecular Weight: | 443.92 |
| Molecular Formula: | C20 H23 Cl F N O5 S |
| Smiles: | CCC(C)N(Cc1cc(ccc1OS(c1ccc(cc1)F)(=O)=O)[Cl])C(COC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.1318 |
| logD: | 4.1318 |
| logSw: | -4.4603 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 59.794 |
| InChI Key: | CTZKQJOANRNOTM-AWEZNQCLSA-N |