3-[(3-chloro-4-methoxyanilino)methylidene]-1-[(4-fluorophenyl)methyl]-2lambda~6~-thieno[3,2-c][1,2]thiazine-2,2,4(1H,3H)-trione
Chemical Structure Depiction of
3-[(3-chloro-4-methoxyanilino)methylidene]-1-[(4-fluorophenyl)methyl]-2lambda~6~-thieno[3,2-c][1,2]thiazine-2,2,4(1H,3H)-trione
3-[(3-chloro-4-methoxyanilino)methylidene]-1-[(4-fluorophenyl)methyl]-2lambda~6~-thieno[3,2-c][1,2]thiazine-2,2,4(1H,3H)-trione
Compound characteristics
| Compound ID: | E953-0333 |
| Compound Name: | 3-[(3-chloro-4-methoxyanilino)methylidene]-1-[(4-fluorophenyl)methyl]-2lambda~6~-thieno[3,2-c][1,2]thiazine-2,2,4(1H,3H)-trione |
| Molecular Weight: | 478.95 |
| Molecular Formula: | C21 H16 Cl F N2 O4 S2 |
| Smiles: | COc1ccc(cc1[Cl])N/C=C1/C(c2c(ccs2)N(Cc2ccc(cc2)F)S1(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5299 |
| logD: | 4.5259 |
| logSw: | -4.6299 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.158 |
| InChI Key: | AAMLXMVCPOTLPF-UHFFFAOYSA-N |