N-[(oxolan-2-yl)methyl]-2-[2-(1,1,3-trioxo-1,3-dihydro-2H-1lambda~6~,2-benzothiazol-2-yl)acetamido]benzamide
Chemical Structure Depiction of
N-[(oxolan-2-yl)methyl]-2-[2-(1,1,3-trioxo-1,3-dihydro-2H-1lambda~6~,2-benzothiazol-2-yl)acetamido]benzamide
N-[(oxolan-2-yl)methyl]-2-[2-(1,1,3-trioxo-1,3-dihydro-2H-1lambda~6~,2-benzothiazol-2-yl)acetamido]benzamide
Compound characteristics
| Compound ID: | D257-0694 |
| Compound Name: | N-[(oxolan-2-yl)methyl]-2-[2-(1,1,3-trioxo-1,3-dihydro-2H-1lambda~6~,2-benzothiazol-2-yl)acetamido]benzamide |
| Molecular Weight: | 443.48 |
| Molecular Formula: | C21 H21 N3 O6 S |
| Smiles: | C1CC(CNC(c2ccccc2NC(CN2C(c3ccccc3S2(=O)=O)=O)=O)=O)OC1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.5603 |
| logD: | 0.56 |
| logSw: | -2.4058 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 100.703 |
| InChI Key: | KEJIKVYDIZSYAG-CQSZACIVSA-N |