| MolName | (E)-1-(4-chlorophenyl)-3-[3-[(E)-3-(4-chlorophenyl)-3-oxoprop-1-enyl]phenyl]prop-2-en-1-one |
| MolecularFormula | C24H16O2Cl2 |
| Smiles | O=C(/C=C/c1cccc(/C=C/C(c(cc2)ccc2Cl)=O)c1)c(cc1)ccc1Cl |
| InChI | InChI=1S/C24H16Cl2O2/c25-21-10-6-19(7-11-21)23(27)14-4-17-2-1-3-18(16-17)5-15-24(28)20-8-12-22(26)13-9-20/h1-16H |
| InChIK | MXWBELBVYZYDOU-UHFFFAOYSA-N |
| TotalMolweight | 407.295 |
| Molweight | 407.295 |
| MonoisotopicMass | 406.052734 |
| CLogP | 6.16 |
| CLogS | -7.536 |
| H Acceptors | 2 |
| TotalSurfaceArea | 312.12 |
| Relative PSA | 0.083558 |
| PolarSurfaceArea | 34.14 |
| Druglikeness | 0.19772 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.67857 |
| Fragments | 1 |
| Non HAtoms | 28 |
| NonCHAtoms | 4 |
| Electronegative Atoms | 4 |
| Rotatable Bond | 6 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Symmetricatoms | 15 |
| StereoCon |
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1 - (E)-1-(4-chlorophenyl)-3-[3-[(E)-3-(4-chlorophenyl)-3-oxoprop-1-enyl]phenyl]prop-2-en-1-one | 2 - (E)-1-(4-chlorophenyl)-3-[3-[(E)-3-(4-chlorophenyl)-3-oxoprop-1-enyl]phenyl]prop-2-en-1-one