1-benzyl-3-[(5-chloro-2,4-dimethoxyanilino)methylidene]-2lambda~6~-thieno[3,2-c][1,2]thiazine-2,2,4(1H,3H)-trione
Chemical Structure Depiction of
1-benzyl-3-[(5-chloro-2,4-dimethoxyanilino)methylidene]-2lambda~6~-thieno[3,2-c][1,2]thiazine-2,2,4(1H,3H)-trione
1-benzyl-3-[(5-chloro-2,4-dimethoxyanilino)methylidene]-2lambda~6~-thieno[3,2-c][1,2]thiazine-2,2,4(1H,3H)-trione
Compound characteristics
| Compound ID: | E953-0071 |
| Compound Name: | 1-benzyl-3-[(5-chloro-2,4-dimethoxyanilino)methylidene]-2lambda~6~-thieno[3,2-c][1,2]thiazine-2,2,4(1H,3H)-trione |
| Molecular Weight: | 490.98 |
| Molecular Formula: | C22 H19 Cl N2 O5 S2 |
| Smiles: | COc1cc(c(cc1N/C=C1/C(c2c(ccs2)N(Cc2ccccc2)S1(=O)=O)=O)[Cl])OC |
| Stereo: | ACHIRAL |
| logP: | 4.63 |
| logD: | 4.5311 |
| logSw: | -4.8775 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.091 |
| InChI Key: | BTRGMCSYLJERAU-UHFFFAOYSA-N |