1-benzyl-3-[(2,6-dichloroanilino)methylidene]-2lambda~6~,1-benzothiazine-2,2,4(1H,3H)-trione
Chemical Structure Depiction of
1-benzyl-3-[(2,6-dichloroanilino)methylidene]-2lambda~6~,1-benzothiazine-2,2,4(1H,3H)-trione
1-benzyl-3-[(2,6-dichloroanilino)methylidene]-2lambda~6~,1-benzothiazine-2,2,4(1H,3H)-trione
Compound characteristics
| Compound ID: | C200-3306 |
| Compound Name: | 1-benzyl-3-[(2,6-dichloroanilino)methylidene]-2lambda~6~,1-benzothiazine-2,2,4(1H,3H)-trione |
| Molecular Weight: | 459.35 |
| Molecular Formula: | C22 H16 Cl2 N2 O3 S |
| Smiles: | C(c1ccccc1)N1c2ccccc2C(/C(=C/Nc2c(cccc2[Cl])[Cl])S1(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1462 |
| logD: | 5.0587 |
| logSw: | -5.4356 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.114 |
| InChI Key: | VONVLDDJSZCSTF-UHFFFAOYSA-N |