(5E)-3-benzyl-5-[(1-benzylindol-3-yl)methylidene]imidazolidine-2,4-dione
Formula:C26H21N3O2
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(5E)-3-benzyl-5-[(1-benzylindol-3-yl)methylidene]imidazolidine-2,4-dione is a drug-like molecule.
| MolName | (5E)-3-benzyl-5-[(1-benzylindol-3-yl)methylidene]imidazolidine-2,4-dione |
| MolecularFormula | C26H21N3O2 |
| Smiles | O=C(/C(/N1)=C\c2cn(Cc3ccccc3)c3c2cccc3)N(Cc2ccccc2)C1=O |
| InChI | InChI=1S/C26H21N3O2/c30-25-23(27-26(31)29(25)17-20-11-5-2-6-12-20)15-21-18-28(16-19-9-3-1-4-10-19)24-14-8-7-13-22(21)24/h1-15,18H,16-17H2,(H,27,31) |
| InChIK | ANTYWQDNYWIKRS-UHFFFAOYSA-N |
| TotalMolweight | 407.472 |
| Molweight | 407.472 |
| MonoisotopicMass | 407.163377 |
| CLogP | 4.069 |
| CLogS | -4.675 |
| H Acceptors | 5 |
| H Donors | 1 |
| TotalSurfaceArea | 312.57 |
| Relative PSA | 0.15344 |
| PolarSurfaceArea | 54.34 |
| Druglikeness | 5.02 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | limit! 5-methylene-imidazolidine-2,4-dione |
| Shape Index | 0.54839 |
| Fragments | 1 |
| Non HAtoms | 31 |
| NonCHAtoms | 5 |
| Electronegative Atoms | 5 |
| Rotatable Bond | 5 |
| Rings Closures | 5 |
| Small Rings | 5 |
| Aromatic Rings | 4 |
| Aromatic Atoms | 21 |
| Sp3Atoms | 2 |
| Symmetricatoms | 4 |
| Amides | 2 |
| Aromatic Nitrogens | 1 |
| StereoCon |
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1 - (5E)-3-benzyl-5-[(1-benzylindol-3-yl)methylidene]imidazolidine-2,4-dione | 2 - (5E)-3-benzyl-5-[(1-benzylindol-3-yl)methylidene]imidazolidine-2,4-dione
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