1-[(4-chlorophenyl)methyl]-3-[(3-fluoro-4-methylanilino)methylidene]-2lambda~6~-thieno[3,2-c][1,2]thiazine-2,2,4(1H,3H)-trione
Chemical Structure Depiction of
1-[(4-chlorophenyl)methyl]-3-[(3-fluoro-4-methylanilino)methylidene]-2lambda~6~-thieno[3,2-c][1,2]thiazine-2,2,4(1H,3H)-trione
1-[(4-chlorophenyl)methyl]-3-[(3-fluoro-4-methylanilino)methylidene]-2lambda~6~-thieno[3,2-c][1,2]thiazine-2,2,4(1H,3H)-trione
Compound characteristics
| Compound ID: | E953-0234 |
| Compound Name: | 1-[(4-chlorophenyl)methyl]-3-[(3-fluoro-4-methylanilino)methylidene]-2lambda~6~-thieno[3,2-c][1,2]thiazine-2,2,4(1H,3H)-trione |
| Molecular Weight: | 462.95 |
| Molecular Formula: | C21 H16 Cl F N2 O3 S2 |
| Smiles: | Cc1ccc(cc1F)N/C=C1/C(c2c(ccs2)N(Cc2ccc(cc2)[Cl])S1(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2347 |
| logD: | 5.2322 |
| logSw: | -5.6653 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.528 |
| InChI Key: | VOXPPODMXPSHRC-UHFFFAOYSA-N |