(5E)-3-(3-chlorophenyl)-5-[(2-phenylmethoxyphenyl)methylidene]imidazolidine-2,4-dione
Formula:C23H17N2O3Cl
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(5E)-3-(3-chlorophenyl)-5-[(2-phenylmethoxyphenyl)methylidene]imidazolidine-2,4-dione is a drug-like molecule.
| MolName | (5E)-3-(3-chlorophenyl)-5-[(2-phenylmethoxyphenyl)methylidene]imidazolidine-2,4-dione |
| MolecularFormula | C23H17N2O3Cl |
| Smiles | O=C(/C(/NC1=O)=C\c(cccc2)c2OCc2ccccc2)N1c1cccc(Cl)c1 |
| InChI | InChI=1S/C23H17ClN2O3/c24-18-10-6-11-19(14-18)26-22(27)20(25-23(26)28)13-17-9-4-5-12-21(17)29-15-16-7-2-1-3-8-16/h1-14H,15H2,(H,25,28) |
| InChIK | LEBXMUPUGSJJIC-UHFFFAOYSA-N |
| TotalMolweight | 404.852 |
| Molweight | 404.852 |
| MonoisotopicMass | 404.09277 |
| CLogP | 4.5705 |
| CLogS | -6.296 |
| H Acceptors | 5 |
| H Donors | 1 |
| TotalSurfaceArea | 300.43 |
| Relative PSA | 0.17006 |
| PolarSurfaceArea | 58.64 |
| Druglikeness | 3.6167 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | limit! 5-methylene-imidazolidine-2,4-dione |
| Shape Index | 0.55172 |
| Fragments | 1 |
| Non HAtoms | 29 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 5 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 2 |
| Symmetricatoms | 2 |
| Amides | 2 |
| StereoCon |
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1 - (5E)-3-(3-chlorophenyl)-5-[(2-phenylmethoxyphenyl)methylidene]imidazolidine-2,4-dione | 2 - (5E)-3-(3-chlorophenyl)-5-[(2-phenylmethoxyphenyl)methylidene]imidazolidine-2,4-dione
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