(5Z)-5-[(4-morpholin-4-ylphenyl)methylidene]-3-phenyl-2-phenylimino-1,3-thiazolidin-4-one
Formula:C26H23N3O2S
Mutagenic:high
Tumorigenic:low
Reproductive Effective:none
(5Z)-5-[(4-morpholin-4-ylphenyl)methylidene]-3-phenyl-2-phenylimino-1,3-thiazolidin-4-one is a drug-like molecule.
| MolName | (5Z)-5-[(4-morpholin-4-ylphenyl)methylidene]-3-phenyl-2-phenylimino-1,3-thiazolidin-4-one |
| MolecularFormula | C26H23N3O2S |
| Smiles | O=C(/C(/S/C1=N\c2ccccc2)=C/c(cc2)ccc2N2CCOCC2)N1c1ccccc1 |
| InChI | InChI=1S/C26H23N3O2S/c30-25-24(19-20-11-13-22(14-12-20)28-15-17-31-18-16-28)32-26(27-21-7-3-1-4-8-21)29(25)23-9-5-2-6-10-23/h1-14,19H,15-18H2 |
| InChIK | ZXSBMSDOJFHBCQ-UHFFFAOYSA-N |
| TotalMolweight | 441.554 |
| Molweight | 441.554 |
| MonoisotopicMass | 441.151097 |
| CLogP | 4.347 |
| CLogS | -5.953 |
| H Acceptors | 5 |
| TotalSurfaceArea | 334.34 |
| Relative PSA | 0.17689 |
| PolarSurfaceArea | 70.44 |
| Druglikeness | 3.759 |
| Mutagenic | high |
| Tumorigenic | low |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.53125 |
| Fragments | 1 |
| Non HAtoms | 32 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 4 |
| Rings Closures | 5 |
| Small Rings | 5 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 6 |
| Symmetricatoms | 8 |
| Amides | 1 |
| Amines | 1 |
| Aromatic Amines | 1 |
| StereoCon |
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1 - (5Z)-5-[(4-morpholin-4-ylphenyl)methylidene]-3-phenyl-2-phenylimino-1,3-thiazolidin-4-one | 2 - (5Z)-5-[(4-morpholin-4-ylphenyl)methylidene]-3-phenyl-2-phenylimino-1,3-thiazolidin-4-one
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