| MolName | (5E)-5-[(2-chlorophenyl)methylidene]-1,3-diphenyl-2-sulfanylideneimidazolidin-4-one |
| MolecularFormula | C22H15N2OClS |
| Smiles | O=C(/C(/N(C1=S)c2ccccc2)=C\c(cccc2)c2Cl)N1c1ccccc1 |
| InChI | InChI=1S/C22H15ClN2OS/c23-19-14-8-7-9-16(19)15-20-21(26)25(18-12-5-2-6-13-18)22(27)24(20)17-10-3-1-4-11-17/h1-15H |
| InChIK | AXUXGHFLOUMECP-UHFFFAOYSA-N |
| TotalMolweight | 390.893 |
| Molweight | 390.893 |
| MonoisotopicMass | 390.05936 |
| CLogP | 5.331 |
| CLogS | -6.522 |
| H Acceptors | 3 |
| TotalSurfaceArea | 290.47 |
| Relative PSA | 0.16573 |
| PolarSurfaceArea | 55.64 |
| Druglikeness | 2.6101 |
| Mutagenic | none |
| Tumorigenic | high |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | thio-amide/urea |
| Shape Index | 0.44444 |
| Fragments | 1 |
| Non HAtoms | 27 |
| NonCHAtoms | 5 |
| Electronegative Atoms | 5 |
| Rotatable Bond | 3 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 1 |
| Symmetricatoms | 4 |
| Amides | 1 |
| StereoCon |
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1 - (5E)-5-[(2-chlorophenyl)methylidene]-1,3-diphenyl-2-sulfanylideneimidazolidin-4-one | 2 - (5E)-5-[(2-chlorophenyl)methylidene]-1,3-diphenyl-2-sulfanylideneimidazolidin-4-one