3-(2H-1,3-benzodioxol-5-yl)-N-[6-(diethylsulfamoyl)-1,3-benzothiazol-2-yl]prop-2-enamide
Chemical Structure Depiction of
3-(2H-1,3-benzodioxol-5-yl)-N-[6-(diethylsulfamoyl)-1,3-benzothiazol-2-yl]prop-2-enamide
3-(2H-1,3-benzodioxol-5-yl)-N-[6-(diethylsulfamoyl)-1,3-benzothiazol-2-yl]prop-2-enamide
Compound characteristics
| Compound ID: | G786-1571 |
| Compound Name: | 3-(2H-1,3-benzodioxol-5-yl)-N-[6-(diethylsulfamoyl)-1,3-benzothiazol-2-yl]prop-2-enamide |
| Molecular Weight: | 459.54 |
| Molecular Formula: | C21 H21 N3 O5 S2 |
| Smiles: | CCN(CC)S(c1ccc2c(c1)sc(NC(/C=C/c1ccc3c(c1)OCO3)=O)n2)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6877 |
| logD: | 4.6876 |
| logSw: | -4.4421 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.09 |
| InChI Key: | NSUXLLMLSHUWMY-UHFFFAOYSA-N |