| MolName | 4-(2,4-dichlorophenoxy)-N'-[(E)-3-naphthalen-1-ylprop-2-enoyl]butanehydrazide |
| MolecularFormula | C23H20N2O3Cl2 |
| Smiles | O=C(CCCOc(ccc(Cl)c1)c1Cl)NNC(/C=C/c1cccc2ccccc12)=O |
| InChI | InChI=1S/C23H20Cl2N2O3/c24-18-11-12-21(20(25)15-18)30-14-4-9-22(28)26-27-23(29)13-10-17-7-3-6-16-5-1-2-8-19(16)17/h1-3,5-8,10-13,15H,4,9,14H2,(H,26,28)(H,27,29) |
| InChIK | FVNRBGGLAJDXFA-UHFFFAOYSA-N |
| TotalMolweight | 443.329 |
| Molweight | 443.329 |
| MonoisotopicMass | 442.085097 |
| CLogP | 4.8369 |
| CLogS | -7.078 |
| H Acceptors | 5 |
| H Donors | 2 |
| TotalSurfaceArea | 334.66 |
| Relative PSA | 0.1763 |
| PolarSurfaceArea | 67.43 |
| Druglikeness | -3.4024 |
| Mutagenic | high |
| Tumorigenic | high |
| Reproductive Effective | high |
| Irritant | high |
| Nasty Functions | |
| Shape Index | 0.66667 |
| Fragments | 1 |
| Non HAtoms | 30 |
| NonCHAtoms | 7 |
| Electronegative Atoms | 7 |
| Rotatable Bond | 8 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 16 |
| Sp3Atoms | 4 |
| StereoCon |
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1 - 4-(2,4-dichlorophenoxy)-N'-[(E)-3-naphthalen-1-ylprop-2-enoyl]butanehydrazide | 2 - 4-(2,4-dichlorophenoxy)-N'-[(E)-3-naphthalen-1-ylprop-2-enoyl]butanehydrazide