(5Z)-3-benzyl-5-[(3-bromo-4-phenylmethoxyphenyl)methylidene]imidazolidine-2,4-dione
Formula:C24H19N2O3Br
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(5Z)-3-benzyl-5-[(3-bromo-4-phenylmethoxyphenyl)methylidene]imidazolidine-2,4-dione is a drug-like molecule.
| MolName | (5Z)-3-benzyl-5-[(3-bromo-4-phenylmethoxyphenyl)methylidene]imidazolidine-2,4-dione |
| MolecularFormula | C24H19N2O3Br |
| Smiles | O=C(/C(/N1)=C/c(cc2)cc(Br)c2OCc2ccccc2)N(Cc2ccccc2)C1=O |
| InChI | InChI=1S/C24H19BrN2O3/c25-20-13-19(11-12-22(20)30-16-18-9-5-2-6-10-18)14-21-23(28)27(24(29)26-21)15-17-7-3-1-4-8-17/h1-14H,15-16H2,(H,26,29) |
| InChIK | YFOCQYWNYPTIPI-UHFFFAOYSA-N |
| TotalMolweight | 463.33 |
| Molweight | 463.33 |
| MonoisotopicMass | 462.057904 |
| CLogP | 4.6126 |
| CLogS | -5.872 |
| H Acceptors | 5 |
| H Donors | 1 |
| TotalSurfaceArea | 317.4 |
| Relative PSA | 0.16096 |
| PolarSurfaceArea | 58.64 |
| Druglikeness | 2.8633 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | limit! 5-methylene-imidazolidine-2,4-dione |
| Shape Index | 0.63333 |
| Fragments | 1 |
| Non HAtoms | 30 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 6 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 3 |
| Symmetricatoms | 4 |
| Amides | 2 |
| StereoCon |
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1 - (5Z)-3-benzyl-5-[(3-bromo-4-phenylmethoxyphenyl)methylidene]imidazolidine-2,4-dione | 2 - (5Z)-3-benzyl-5-[(3-bromo-4-phenylmethoxyphenyl)methylidene]imidazolidine-2,4-dione
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