(5E)-3-[(4-bromophenyl)methyl]-5-[(4-phenylphenyl)methylidene]imidazolidine-2,4-dione
Formula:C23H17N2O2Br
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(5E)-3-[(4-bromophenyl)methyl]-5-[(4-phenylphenyl)methylidene]imidazolidine-2,4-dione is a drug-like molecule.
| MolName | (5E)-3-[(4-bromophenyl)methyl]-5-[(4-phenylphenyl)methylidene]imidazolidine-2,4-dione |
| MolecularFormula | C23H17N2O2Br |
| Smiles | O=C(/C(/N1)=C\c(cc2)ccc2-c2ccccc2)N(Cc(cc2)ccc2Br)C1=O |
| InChI | InChI=1S/C23H17BrN2O2/c24-20-12-8-17(9-13-20)15-26-22(27)21(25-23(26)28)14-16-6-10-19(11-7-16)18-4-2-1-3-5-18/h1-14H,15H2,(H,25,28) |
| InChIK | DXBJXTKBTFVYFY-UHFFFAOYSA-N |
| TotalMolweight | 433.304 |
| Molweight | 433.304 |
| MonoisotopicMass | 432.047339 |
| CLogP | 4.9237 |
| CLogS | -6.617 |
| H Acceptors | 4 |
| H Donors | 1 |
| TotalSurfaceArea | 293.64 |
| Relative PSA | 0.13993 |
| PolarSurfaceArea | 49.41 |
| Druglikeness | 3.0665 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | limit! 5-methylene-imidazolidine-2,4-dione |
| Shape Index | 0.64286 |
| Fragments | 1 |
| Non HAtoms | 28 |
| NonCHAtoms | 5 |
| Electronegative Atoms | 5 |
| Rotatable Bond | 4 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 1 |
| Symmetricatoms | 6 |
| Amides | 2 |
| StereoCon |
Click to Load Molecule:
1 - (5E)-3-[(4-bromophenyl)methyl]-5-[(4-phenylphenyl)methylidene]imidazolidine-2,4-dione | 2 - (5E)-3-[(4-bromophenyl)methyl]-5-[(4-phenylphenyl)methylidene]imidazolidine-2,4-dione
Spacefill |
Wire |
Ball & Stick |
Iso-vdw |
Opaque |
Dot Surface |
Mep |
Translucent |
Spin |
Label On |
Off