2-{3-[3-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]-2-oxo-2,3-dihydro-1H-indol-1-yl}-N-(4-fluorophenyl)acetamide
Chemical Structure Depiction of
2-{3-[3-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]-2-oxo-2,3-dihydro-1H-indol-1-yl}-N-(4-fluorophenyl)acetamide
2-{3-[3-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]-2-oxo-2,3-dihydro-1H-indol-1-yl}-N-(4-fluorophenyl)acetamide
Compound characteristics
| Compound ID: | 4340-0602 |
| Compound Name: | 2-{3-[3-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]-2-oxo-2,3-dihydro-1H-indol-1-yl}-N-(4-fluorophenyl)acetamide |
| Molecular Weight: | 531.6 |
| Molecular Formula: | C23 H18 F N3 O5 S3 |
| Smiles: | C1CS(CC1N1C(/C(=C2C(N(CC(Nc3ccc(cc3)F)=O)c3ccccc\23)=O)SC1=S)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.9698 |
| logD: | 1.9697 |
| logSw: | -2.9723 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.719 |
| InChI Key: | ZKLHKWJWDSFQMG-OAHLLOKOSA-N |