2-{[(methoxyacetyl)(2-methylpropyl)amino]methyl}phenyl 3-fluoro-4-methoxybenzene-1-sulfonate
Chemical Structure Depiction of
2-{[(methoxyacetyl)(2-methylpropyl)amino]methyl}phenyl 3-fluoro-4-methoxybenzene-1-sulfonate
2-{[(methoxyacetyl)(2-methylpropyl)amino]methyl}phenyl 3-fluoro-4-methoxybenzene-1-sulfonate
Compound characteristics
| Compound ID: | V029-2681 |
| Compound Name: | 2-{[(methoxyacetyl)(2-methylpropyl)amino]methyl}phenyl 3-fluoro-4-methoxybenzene-1-sulfonate |
| Molecular Weight: | 439.5 |
| Molecular Formula: | C21 H26 F N O6 S |
| Smiles: | CC(C)CN(Cc1ccccc1OS(c1ccc(c(c1)F)OC)(=O)=O)C(COC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.25 |
| logD: | 3.25 |
| logSw: | -3.6407 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 68.096 |
| InChI Key: | BNJBMPBWANJIAF-UHFFFAOYSA-N |