2-methoxy-5-{[(methoxyacetyl)(2-methylpropyl)amino]methyl}phenyl 4-fluorobenzene-1-sulfonate
Chemical Structure Depiction of
2-methoxy-5-{[(methoxyacetyl)(2-methylpropyl)amino]methyl}phenyl 4-fluorobenzene-1-sulfonate
2-methoxy-5-{[(methoxyacetyl)(2-methylpropyl)amino]methyl}phenyl 4-fluorobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V001-0928 |
| Compound Name: | 2-methoxy-5-{[(methoxyacetyl)(2-methylpropyl)amino]methyl}phenyl 4-fluorobenzene-1-sulfonate |
| Molecular Weight: | 439.5 |
| Molecular Formula: | C21 H26 F N O6 S |
| Smiles: | CC(C)CN(Cc1ccc(c(c1)OS(c1ccc(cc1)F)(=O)=O)OC)C(COC)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8229 |
| logD: | 2.8229 |
| logSw: | -3.3795 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 68.096 |
| InChI Key: | JETGLBMNWNLEGP-UHFFFAOYSA-N |