| MolName | (5E)-5-[[5-(2,3-dichlorophenyl)furan-2-yl]methylidene]-3-phenyl-2-phenylimino-1,3-thiazolidin-4-one |
| MolecularFormula | C26H16N2O2Cl2S |
| Smiles | O=C(/C(/S/C1=N\c2ccccc2)=C\c2ccc(-c3cccc(Cl)c3Cl)o2)N1c1ccccc1 |
| InChI | InChI=1S/C26H16Cl2N2O2S/c27-21-13-7-12-20(24(21)28)22-15-14-19(32-22)16-23-25(31)30(18-10-5-2-6-11-18)26(33-23)29-17-8-3-1-4-9-17/h1-16H |
| InChIK | KTJLPQXANMDFGJ-UHFFFAOYSA-N |
| TotalMolweight | 491.397 |
| Molweight | 491.397 |
| MonoisotopicMass | 490.030952 |
| CLogP | 6.8289 |
| CLogS | -8.782 |
| H Acceptors | 4 |
| TotalSurfaceArea | 352.79 |
| Relative PSA | 0.16922 |
| PolarSurfaceArea | 71.11 |
| Druglikeness | 4.335 |
| Mutagenic | high |
| Tumorigenic | high |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.48485 |
| Fragments | 1 |
| Non HAtoms | 33 |
| NonCHAtoms | 7 |
| Electronegative Atoms | 7 |
| Rotatable Bond | 4 |
| Rings Closures | 5 |
| Small Rings | 5 |
| Aromatic Rings | 4 |
| Aromatic Atoms | 23 |
| Sp3Atoms | 1 |
| Symmetricatoms | 4 |
| Amides | 1 |
| StereoCon |
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1 - (5E)-5-[[5-(2,3-dichlorophenyl)furan-2-yl]methylidene]-3-phenyl-2-phenylimino-1,3-thiazolidin-4-one | 2 - (5E)-5-[[5-(2,3-dichlorophenyl)furan-2-yl]methylidene]-3-phenyl-2-phenylimino-1,3-thiazolidin-4-one