1-benzyl-3-[(3,5-dimethylanilino)methylidene]-2lambda~6~,1-benzothiazine-2,2,4(1H,3H)-trione
Chemical Structure Depiction of
1-benzyl-3-[(3,5-dimethylanilino)methylidene]-2lambda~6~,1-benzothiazine-2,2,4(1H,3H)-trione
1-benzyl-3-[(3,5-dimethylanilino)methylidene]-2lambda~6~,1-benzothiazine-2,2,4(1H,3H)-trione
Compound characteristics
| Compound ID: | E745-0072 |
| Compound Name: | 1-benzyl-3-[(3,5-dimethylanilino)methylidene]-2lambda~6~,1-benzothiazine-2,2,4(1H,3H)-trione |
| Molecular Weight: | 418.51 |
| Molecular Formula: | C24 H22 N2 O3 S |
| Smiles: | Cc1cc(C)cc(c1)N\C=C1/C(c2ccccc2N(Cc2ccccc2)S1(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5705 |
| logD: | 4.5705 |
| logSw: | -4.5102 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.509 |
| InChI Key: | JFZMTAUAYCMDLY-UHFFFAOYSA-N |