(4Z)-2-(4-chlorophenyl)-4-[[2-[(4-chlorophenyl)methoxy]phenyl]methylidene]-1,3-oxazol-5-one
Formula:C23H15NO3Cl2
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(4Z)-2-(4-chlorophenyl)-4-[[2-[(4-chlorophenyl)methoxy]phenyl]methylidene]-1,3-oxazol-5-one is not a drug-like molecule.
| MolName | (4Z)-2-(4-chlorophenyl)-4-[[2-[(4-chlorophenyl)methoxy]phenyl]methylidene]-1,3-oxazol-5-one |
| MolecularFormula | C23H15NO3Cl2 |
| Smiles | O=C1OC(c(cc2)ccc2Cl)=N/C1=C\c(cccc1)c1OCc(cc1)ccc1Cl |
| InChI | InChI=1S/C23H15Cl2NO3/c24-18-9-5-15(6-10-18)14-28-21-4-2-1-3-17(21)13-20-23(27)29-22(26-20)16-7-11-19(25)12-8-16/h1-13H,14H2 |
| InChIK | GCMBKRTUMDIFPT-UHFFFAOYSA-N |
| TotalMolweight | 424.282 |
| Molweight | 424.282 |
| MonoisotopicMass | 423.042898 |
| CLogP | 5.1519 |
| CLogS | -6.732 |
| H Acceptors | 4 |
| TotalSurfaceArea | 309.31 |
| Relative PSA | 0.14403 |
| PolarSurfaceArea | 47.89 |
| Druglikeness | 0.80549 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.62069 |
| 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 | 3 |
| Symmetricatoms | 4 |
| StereoCon |
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