4-fluoro-N-[(Z)-[(5Z)-5-[(4-fluorobenzoyl)hydrazinylidene]pentylidene]amino]benzamide
Formula:C19H18N4O2F2
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
4-fluoro-N-[(Z)-[(5Z)-5-[(4-fluorobenzoyl)hydrazinylidene]pentylidene]amino]benzamide is a drug-like molecule.
| MolName | 4-fluoro-N-[(Z)-[(5Z)-5-[(4-fluorobenzoyl)hydrazinylidene]pentylidene]amino]benzamide |
| MolecularFormula | C19H18N4O2F2 |
| Smiles | O=C(c(cc1)ccc1F)N/N=C\CCC/C=N\NC(c(cc1)ccc1F)=O |
| InChI | InChI=1S/C19H18F2N4O2/c20-16-8-4-14(5-9-16)18(26)24-22-12-2-1-3-13-23-25-19(27)15-6-10-17(21)11-7-15/h4-13H,1-3H2,(H,24,26)(H,25,27) |
| InChIK | CIEBZYOJOHMOAQ-UHFFFAOYSA-N |
| TotalMolweight | 372.374 |
| Molweight | 372.374 |
| MonoisotopicMass | 372.139782 |
| CLogP | 3.4814 |
| CLogS | -5.4 |
| H Acceptors | 6 |
| H Donors | 2 |
| TotalSurfaceArea | 294.94 |
| Relative PSA | 0.24419 |
| PolarSurfaceArea | 82.92 |
| Druglikeness | 0.052278 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde |
| Shape Index | 0.77778 |
| Fragments | 1 |
| Non HAtoms | 27 |
| NonCHAtoms | 8 |
| Electronegative Atoms | 8 |
| Rotatable Bond | 8 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 3 |
| Symmetricatoms | 15 |
| StereoCon |
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1 - 4-fluoro-N-[(Z)-[(5Z)-5-[(4-fluorobenzoyl)hydrazinylidene]pentylidene]amino]benzamide | 2 - 4-fluoro-N-[(Z)-[(5Z)-5-[(4-fluorobenzoyl)hydrazinylidene]pentylidene]amino]benzamide
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