3-[(2-bromoanilino)methylidene]-1-[(3-fluorophenyl)methyl]-2lambda~6~-thieno[3,2-c][1,2]thiazine-2,2,4(1H,3H)-trione
Chemical Structure Depiction of
3-[(2-bromoanilino)methylidene]-1-[(3-fluorophenyl)methyl]-2lambda~6~-thieno[3,2-c][1,2]thiazine-2,2,4(1H,3H)-trione
3-[(2-bromoanilino)methylidene]-1-[(3-fluorophenyl)methyl]-2lambda~6~-thieno[3,2-c][1,2]thiazine-2,2,4(1H,3H)-trione
Compound characteristics
| Compound ID: | E953-0489 |
| Compound Name: | 3-[(2-bromoanilino)methylidene]-1-[(3-fluorophenyl)methyl]-2lambda~6~-thieno[3,2-c][1,2]thiazine-2,2,4(1H,3H)-trione |
| Molecular Weight: | 493.37 |
| Molecular Formula: | C20 H14 Br F N2 O3 S2 |
| Smiles: | C(c1cccc(c1)F)N1c2ccsc2C(/C(=C/Nc2ccccc2[Br])S1(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7056 |
| logD: | 4.7053 |
| logSw: | -4.7374 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.83 |
| InChI Key: | KTDMQPRSQOUHEU-UHFFFAOYSA-N |