(2E,5Z)-5-[(2-chlorophenyl)methylidene]-3-phenyl-2-(phenylhydrazinylidene)-1,3-thiazolidin-4-one
Formula:C22H16N3OClS
Mutagenic:none
Tumorigenic:high
Reproductive Effective:none
(2E,5Z)-5-[(2-chlorophenyl)methylidene]-3-phenyl-2-(phenylhydrazinylidene)-1,3-thiazolidin-4-one is not a drug-like molecule.
| MolName | (2E,5Z)-5-[(2-chlorophenyl)methylidene]-3-phenyl-2-(phenylhydrazinylidene)-1,3-thiazolidin-4-one |
| MolecularFormula | C22H16N3OClS |
| Smiles | O=C(/C(/S/C1=N/Nc2ccccc2)=C/c(cccc2)c2Cl)N1c1ccccc1 |
| InChI | InChI=1S/C22H16ClN3OS/c23-19-14-8-7-9-16(19)15-20-21(27)26(18-12-5-2-6-13-18)22(28-20)25-24-17-10-3-1-4-11-17/h1-15,24H |
| InChIK | LQSCHVKWEFZIDF-UHFFFAOYSA-N |
| TotalMolweight | 405.908 |
| Molweight | 405.908 |
| MonoisotopicMass | 405.070259 |
| CLogP | 7.0915 |
| CLogS | -6.577 |
| H Acceptors | 4 |
| H Donors | 1 |
| TotalSurfaceArea | 299.38 |
| Relative PSA | 0.19056 |
| PolarSurfaceArea | 70 |
| Druglikeness | 4.4916 |
| Mutagenic | none |
| Tumorigenic | high |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.5 |
| Fragments | 1 |
| Non HAtoms | 28 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 4 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 1 |
| Symmetricatoms | 4 |
| Amides | 1 |
| StereoCon |
Click to Load Molecule:
1 - (2E,5Z)-5-[(2-chlorophenyl)methylidene]-3-phenyl-2-(phenylhydrazinylidene)-1,3-thiazolidin-4-one | 2 - (2E,5Z)-5-[(2-chlorophenyl)methylidene]-3-phenyl-2-(phenylhydrazinylidene)-1,3-thiazolidin-4-one
Spacefill |
Wire |
Ball & Stick |
Iso-vdw |
Opaque |
Dot Surface |
Mep |
Translucent |
Spin |
Label On |
Off