| MolName | (5Z)-5-[[5-(2,6-dichlorophenyl)furan-2-yl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one |
| MolecularFormula | C14H7NO2Cl2S2 |
| Smiles | O=C(/C(/S1)=C/c2ccc(-c(c(Cl)ccc3)c3Cl)o2)NC1=S |
| InChI | InChI=1S/C14H7Cl2NO2S2/c15-8-2-1-3-9(16)12(8)10-5-4-7(19-10)6-11-13(18)17-14(20)21-11/h1-6H,(H,17,18,20) |
| InChIK | RXEXSJQPOJDOFK-UHFFFAOYSA-N |
| TotalMolweight | 356.253 |
| Molweight | 356.253 |
| MonoisotopicMass | 354.929523 |
| CLogP | 3.2951 |
| CLogS | -6.432 |
| H Acceptors | 3 |
| H Donors | 1 |
| TotalSurfaceArea | 244.17 |
| Relative PSA | 0.34443 |
| PolarSurfaceArea | 99.63 |
| Druglikeness | 3.4501 |
| Mutagenic | high |
| Tumorigenic | high |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.57143 |
| Fragments | 1 |
| Non HAtoms | 21 |
| NonCHAtoms | 7 |
| Electronegative Atoms | 7 |
| Rotatable Bond | 2 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 11 |
| Sp3Atoms | 2 |
| Symmetricatoms | 3 |
| Amides | 1 |
| StereoCon |
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1 - (5Z)-5-[[5-(2,6-dichlorophenyl)furan-2-yl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one | 2 - (5Z)-5-[[5-(2,6-dichlorophenyl)furan-2-yl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one