N-(2H-1,3-benzodioxol-5-yl)-2-(1,1,3-trioxo-1,3-dihydro-2H-1lambda~6~,2-benzothiazol-2-yl)acetamide
Chemical Structure Depiction of
N-(2H-1,3-benzodioxol-5-yl)-2-(1,1,3-trioxo-1,3-dihydro-2H-1lambda~6~,2-benzothiazol-2-yl)acetamide
N-(2H-1,3-benzodioxol-5-yl)-2-(1,1,3-trioxo-1,3-dihydro-2H-1lambda~6~,2-benzothiazol-2-yl)acetamide
Compound characteristics
| Compound ID: | D034-0203 |
| Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-2-(1,1,3-trioxo-1,3-dihydro-2H-1lambda~6~,2-benzothiazol-2-yl)acetamide |
| Molecular Weight: | 360.34 |
| Molecular Formula: | C16 H12 N2 O6 S |
| Smiles: | C(C(Nc1ccc2c(c1)OCO2)=O)N1C(c2ccccc2S1(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.318 |
| logD: | 1.3179 |
| logSw: | -2.5942 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.449 |
| InChI Key: | MQYCLVOWRZKFTM-UHFFFAOYSA-N |