1-benzyl-3-[(5-chloro-2-methylanilino)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-methylanilino)methylidene]-2lambda~6~-thieno[3,2-c][1,2]thiazine-2,2,4(1H,3H)-trione
1-benzyl-3-[(5-chloro-2-methylanilino)methylidene]-2lambda~6~-thieno[3,2-c][1,2]thiazine-2,2,4(1H,3H)-trione
Compound characteristics
| Compound ID: | E953-0033 |
| Compound Name: | 1-benzyl-3-[(5-chloro-2-methylanilino)methylidene]-2lambda~6~-thieno[3,2-c][1,2]thiazine-2,2,4(1H,3H)-trione |
| Molecular Weight: | 444.96 |
| Molecular Formula: | C21 H17 Cl N2 O3 S2 |
| Smiles: | Cc1ccc(cc1N/C=C1/C(c2c(ccs2)N(Cc2ccccc2)S1(=O)=O)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.9387 |
| logD: | 4.9355 |
| logSw: | -4.9175 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.83 |
| InChI Key: | KPCGRNADXADCIT-UHFFFAOYSA-N |