2-{[(methoxyacetyl)(2-methylpropyl)amino]methyl}phenyl 3-(trifluoromethyl)benzene-1-sulfonate
Chemical Structure Depiction of
2-{[(methoxyacetyl)(2-methylpropyl)amino]methyl}phenyl 3-(trifluoromethyl)benzene-1-sulfonate
2-{[(methoxyacetyl)(2-methylpropyl)amino]methyl}phenyl 3-(trifluoromethyl)benzene-1-sulfonate
Compound characteristics
| Compound ID: | V027-4009 |
| Compound Name: | 2-{[(methoxyacetyl)(2-methylpropyl)amino]methyl}phenyl 3-(trifluoromethyl)benzene-1-sulfonate |
| Molecular Weight: | 459.48 |
| Molecular Formula: | C21 H24 F3 N O5 S |
| Smiles: | CC(C)CN(Cc1ccccc1OS(c1cccc(c1)C(F)(F)F)(=O)=O)C(COC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9759 |
| logD: | 3.9759 |
| logSw: | -4.1355 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 60.466 |
| InChI Key: | VBNPWJSRQIHQSZ-UHFFFAOYSA-N |