(5Z)-5-[(2-chloro-6-fluorophenyl)methylidene]-3-(3-chlorophenyl)imidazolidine-2,4-dione
Formula:C16H9N2O2Cl2F
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(5Z)-5-[(2-chloro-6-fluorophenyl)methylidene]-3-(3-chlorophenyl)imidazolidine-2,4-dione is a drug-like molecule.
| MolName | (5Z)-5-[(2-chloro-6-fluorophenyl)methylidene]-3-(3-chlorophenyl)imidazolidine-2,4-dione |
| MolecularFormula | C16H9N2O2Cl2F |
| Smiles | O=C(/C(/NC1=O)=C/c(c(F)ccc2)c2Cl)N1c1cc(Cl)ccc1 |
| InChI | InChI=1S/C16H9Cl2FN2O2/c17-9-3-1-4-10(7-9)21-15(22)14(20-16(21)23)8-11-12(18)5-2-6-13(11)19/h1-8H,(H,20,23) |
| InChIK | ZKJWMLCQTZFINQ-UHFFFAOYSA-N |
| TotalMolweight | 351.163 |
| Molweight | 351.163 |
| MonoisotopicMass | 350.00251 |
| CLogP | 3.9292 |
| CLogS | -6.005 |
| H Acceptors | 4 |
| H Donors | 1 |
| TotalSurfaceArea | 238.68 |
| Relative PSA | 0.17216 |
| PolarSurfaceArea | 49.41 |
| Druglikeness | 2.461 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | limit! 5-methylene-imidazolidine-2,4-dione |
| Shape Index | 0.52174 |
| Fragments | 1 |
| Non HAtoms | 23 |
| NonCHAtoms | 7 |
| Electronegative Atoms | 7 |
| Rotatable Bond | 2 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Amides | 2 |
| StereoCon |
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1 - (5Z)-5-[(2-chloro-6-fluorophenyl)methylidene]-3-(3-chlorophenyl)imidazolidine-2,4-dione | 2 - (5Z)-5-[(2-chloro-6-fluorophenyl)methylidene]-3-(3-chlorophenyl)imidazolidine-2,4-dione
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