(5Z)-3-[2-(4-chlorophenyl)ethyl]-5-[(4-chlorophenyl)methylidene]-2-phenylimidazol-4-one
Formula:C24H18N2OCl2
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(5Z)-3-[2-(4-chlorophenyl)ethyl]-5-[(4-chlorophenyl)methylidene]-2-phenylimidazol-4-one is not a drug-like molecule.
| MolName | (5Z)-3-[2-(4-chlorophenyl)ethyl]-5-[(4-chlorophenyl)methylidene]-2-phenylimidazol-4-one |
| MolecularFormula | C24H18N2OCl2 |
| Smiles | O=C1N(CCc(cc2)ccc2Cl)C(c2ccccc2)=N/C1=C\c(cc1)ccc1Cl |
| InChI | InChI=1S/C24H18Cl2N2O/c25-20-10-6-17(7-11-20)14-15-28-23(19-4-2-1-3-5-19)27-22(24(28)29)16-18-8-12-21(26)13-9-18/h1-13,16H,14-15H2 |
| InChIK | ZLNPEIFTIYNQSM-UHFFFAOYSA-N |
| TotalMolweight | 421.326 |
| Molweight | 421.326 |
| MonoisotopicMass | 420.079617 |
| CLogP | 5.7614 |
| CLogS | -6.328 |
| H Acceptors | 3 |
| TotalSurfaceArea | 313.37 |
| Relative PSA | 0.08967 |
| PolarSurfaceArea | 32.67 |
| Druglikeness | 4.4462 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.55172 |
| Fragments | 1 |
| Non HAtoms | 29 |
| NonCHAtoms | 5 |
| Electronegative Atoms | 5 |
| Rotatable Bond | 5 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 2 |
| Symmetricatoms | 6 |
| Amides | 1 |
| BasicNitrogens | 1 |
| StereoCon |
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1 - (5Z)-3-[2-(4-chlorophenyl)ethyl]-5-[(4-chlorophenyl)methylidene]-2-phenylimidazol-4-one | 2 - (5Z)-3-[2-(4-chlorophenyl)ethyl]-5-[(4-chlorophenyl)methylidene]-2-phenylimidazol-4-one
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