3,4,5-trimethoxy-N-(1,1,3,3-tetraoxo-1,3-dihydro-2H-1lambda~6~,3lambda~6~,2-benzodithiazol-2-yl)benzamide
Chemical Structure Depiction of
3,4,5-trimethoxy-N-(1,1,3,3-tetraoxo-1,3-dihydro-2H-1lambda~6~,3lambda~6~,2-benzodithiazol-2-yl)benzamide
3,4,5-trimethoxy-N-(1,1,3,3-tetraoxo-1,3-dihydro-2H-1lambda~6~,3lambda~6~,2-benzodithiazol-2-yl)benzamide
Compound characteristics
| Compound ID: | K608-0003 |
| Compound Name: | 3,4,5-trimethoxy-N-(1,1,3,3-tetraoxo-1,3-dihydro-2H-1lambda~6~,3lambda~6~,2-benzodithiazol-2-yl)benzamide |
| Molecular Weight: | 428.44 |
| Molecular Formula: | C16 H16 N2 O8 S2 |
| Smiles: | COc1cc(cc(c1OC)OC)C(NN1S(c2ccccc2S1(=O)=O)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.8452 |
| logD: | 0.8452 |
| logSw: | -2.4358 |
| Hydrogen bond acceptors count: | 14 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 111.031 |
| InChI Key: | MAILSNODKXLZOI-UHFFFAOYSA-N |