(5Z)-5-[(2-chloro-6-fluorophenyl)methylidene]-3-[(4-fluorophenyl)methyl]imidazolidine-2,4-dione
Formula:C17H11N2O2ClF2
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(5Z)-5-[(2-chloro-6-fluorophenyl)methylidene]-3-[(4-fluorophenyl)methyl]imidazolidine-2,4-dione is a drug-like molecule.
| MolName | (5Z)-5-[(2-chloro-6-fluorophenyl)methylidene]-3-[(4-fluorophenyl)methyl]imidazolidine-2,4-dione |
| MolecularFormula | C17H11N2O2ClF2 |
| Smiles | O=C(/C(/N1)=C/c(c(F)ccc2)c2Cl)N(Cc(cc2)ccc2F)C1=O |
| InChI | InChI=1S/C17H11ClF2N2O2/c18-13-2-1-3-14(20)12(13)8-15-16(23)22(17(24)21-15)9-10-4-6-11(19)7-5-10/h1-8H,9H2,(H,21,24) |
| InChIK | FRBZTDSPOMQENS-UHFFFAOYSA-N |
| TotalMolweight | 348.735 |
| Molweight | 348.735 |
| MonoisotopicMass | 348.047711 |
| CLogP | 3.3469 |
| CLogS | -5.061 |
| H Acceptors | 4 |
| H Donors | 1 |
| TotalSurfaceArea | 243.37 |
| Relative PSA | 0.16884 |
| PolarSurfaceArea | 49.41 |
| Druglikeness | 3.5617 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | limit! 5-methylene-imidazolidine-2,4-dione |
| Shape Index | 0.58333 |
| Fragments | 1 |
| Non HAtoms | 24 |
| NonCHAtoms | 7 |
| Electronegative Atoms | 7 |
| Rotatable Bond | 3 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 1 |
| Symmetricatoms | 2 |
| Amides | 2 |
| StereoCon |
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1 - (5Z)-5-[(2-chloro-6-fluorophenyl)methylidene]-3-[(4-fluorophenyl)methyl]imidazolidine-2,4-dione | 2 - (5Z)-5-[(2-chloro-6-fluorophenyl)methylidene]-3-[(4-fluorophenyl)methyl]imidazolidine-2,4-dione
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