methyl (6-{[4-chloro-3-(trifluoromethyl)phenyl]sulfamoyl}-3-oxo-2,3-dihydro-4H-1,4-benzothiazin-4-yl)acetate
Chemical Structure Depiction of
methyl (6-{[4-chloro-3-(trifluoromethyl)phenyl]sulfamoyl}-3-oxo-2,3-dihydro-4H-1,4-benzothiazin-4-yl)acetate
methyl (6-{[4-chloro-3-(trifluoromethyl)phenyl]sulfamoyl}-3-oxo-2,3-dihydro-4H-1,4-benzothiazin-4-yl)acetate
Compound characteristics
| Compound ID: | E786-1060 |
| Compound Name: | methyl (6-{[4-chloro-3-(trifluoromethyl)phenyl]sulfamoyl}-3-oxo-2,3-dihydro-4H-1,4-benzothiazin-4-yl)acetate |
| Molecular Weight: | 494.89 |
| Molecular Formula: | C18 H14 Cl F3 N2 O5 S2 |
| Smiles: | COC(CN1C(CSc2ccc(cc12)S(Nc1ccc(c(c1)C(F)(F)F)[Cl])(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.846 |
| logD: | 0.879 |
| logSw: | -4.2736 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.119 |
| InChI Key: | MSDVZTZUOGZLGF-UHFFFAOYSA-N |