N-{5-[2-(4-{[(2H-1,3-benzodioxol-5-yl)methyl]sulfamoyl}phenyl)ethenyl]-3-methyl-1,2-oxazol-4-yl}acetamide
Chemical Structure Depiction of
N-{5-[2-(4-{[(2H-1,3-benzodioxol-5-yl)methyl]sulfamoyl}phenyl)ethenyl]-3-methyl-1,2-oxazol-4-yl}acetamide
N-{5-[2-(4-{[(2H-1,3-benzodioxol-5-yl)methyl]sulfamoyl}phenyl)ethenyl]-3-methyl-1,2-oxazol-4-yl}acetamide
Compound characteristics
| Compound ID: | M026-0074 |
| Compound Name: | N-{5-[2-(4-{[(2H-1,3-benzodioxol-5-yl)methyl]sulfamoyl}phenyl)ethenyl]-3-methyl-1,2-oxazol-4-yl}acetamide |
| Molecular Weight: | 455.49 |
| Molecular Formula: | C22 H21 N3 O6 S |
| Smiles: | CC(Nc1c(C)noc1/C=C\c1ccc(cc1)S(NCc1ccc2c(c1)OCO2)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1965 |
| logD: | 2.1964 |
| logSw: | -2.9836 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 102.494 |
| InChI Key: | XCJBYRYPACWXMS-UHFFFAOYSA-N |