| MolName | (5Z)-3-(3-chlorophenyl)-5-[[2-(2-phenoxyethoxy)phenyl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one |
| MolecularFormula | C24H18NO3ClS2 |
| Smiles | O=C(/C(/SC1=S)=C/c(cccc2)c2OCCOc2ccccc2)N1c1cccc(Cl)c1 |
| InChI | InChI=1S/C24H18ClNO3S2/c25-18-8-6-9-19(16-18)26-23(27)22(31-24(26)30)15-17-7-4-5-12-21(17)29-14-13-28-20-10-2-1-3-11-20/h1-12,15-16H,13-14H2 |
| InChIK | APWDEXGDBYXPTK-UHFFFAOYSA-N |
| TotalMolweight | 467.996 |
| Molweight | 467.996 |
| MonoisotopicMass | 467.041661 |
| CLogP | 4.8533 |
| CLogS | -6.987 |
| H Acceptors | 4 |
| TotalSurfaceArea | 345.18 |
| Relative PSA | 0.23779 |
| PolarSurfaceArea | 96.16 |
| Druglikeness | -4.2172 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.58065 |
| Fragments | 1 |
| Non HAtoms | 31 |
| NonCHAtoms | 7 |
| Electronegative Atoms | 7 |
| Rotatable Bond | 7 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 6 |
| Symmetricatoms | 2 |
| Amides | 1 |
| StereoCon |
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1 - (5Z)-3-(3-chlorophenyl)-5-[[2-(2-phenoxyethoxy)phenyl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one | 2 - (5Z)-3-(3-chlorophenyl)-5-[[2-(2-phenoxyethoxy)phenyl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one