N-[2-(phenylsulfanyl)phenyl]-2-(1,1,3-trioxo-1,3-dihydro-2H-1lambda~6~,2-benzothiazol-2-yl)acetamide
Chemical Structure Depiction of
N-[2-(phenylsulfanyl)phenyl]-2-(1,1,3-trioxo-1,3-dihydro-2H-1lambda~6~,2-benzothiazol-2-yl)acetamide
N-[2-(phenylsulfanyl)phenyl]-2-(1,1,3-trioxo-1,3-dihydro-2H-1lambda~6~,2-benzothiazol-2-yl)acetamide
Compound characteristics
| Compound ID: | D034-0274 |
| Compound Name: | N-[2-(phenylsulfanyl)phenyl]-2-(1,1,3-trioxo-1,3-dihydro-2H-1lambda~6~,2-benzothiazol-2-yl)acetamide |
| Molecular Weight: | 424.5 |
| Molecular Formula: | C21 H16 N2 O4 S2 |
| Smiles: | C(C(Nc1ccccc1Sc1ccccc1)=O)N1C(c2ccccc2S1(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0232 |
| logD: | 3.0232 |
| logSw: | -3.6251 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.364 |
| InChI Key: | RNEUSUOFBNHQTA-UHFFFAOYSA-N |