(4Z)-2-(3-chlorophenyl)-4-[(3-phenylmethoxyphenyl)methylidene]-1,3-oxazol-5-one
Formula:C23H16NO3Cl
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(4Z)-2-(3-chlorophenyl)-4-[(3-phenylmethoxyphenyl)methylidene]-1,3-oxazol-5-one is a drug-like molecule.
| MolName | (4Z)-2-(3-chlorophenyl)-4-[(3-phenylmethoxyphenyl)methylidene]-1,3-oxazol-5-one |
| MolecularFormula | C23H16NO3Cl |
| Smiles | O=C1OC(c2cccc(Cl)c2)=N/C1=C\c1cc(OCc2ccccc2)ccc1 |
| InChI | InChI=1S/C23H16ClNO3/c24-19-10-5-9-18(14-19)22-25-21(23(26)28-22)13-17-8-4-11-20(12-17)27-15-16-6-2-1-3-7-16/h1-14H,15H2 |
| InChIK | KTFZCLQVEWVKEC-UHFFFAOYSA-N |
| TotalMolweight | 389.837 |
| Molweight | 389.837 |
| MonoisotopicMass | 389.081871 |
| CLogP | 4.5459 |
| CLogS | -5.996 |
| H Acceptors | 4 |
| TotalSurfaceArea | 293.89 |
| Relative PSA | 0.15159 |
| PolarSurfaceArea | 47.89 |
| Druglikeness | 0.80549 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.60714 |
| Fragments | 1 |
| Non HAtoms | 28 |
| NonCHAtoms | 5 |
| Electronegative Atoms | 5 |
| Rotatable Bond | 5 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 3 |
| Symmetricatoms | 2 |
| StereoCon |
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