N,N'-bis[(Z)-naphthalen-1-ylmethylideneamino]propanediamide
Formula:C25H20N4O2
Mutagenic:none
Tumorigenic:high
Reproductive Effective:none
N,N'-bis[(Z)-naphthalen-1-ylmethylideneamino]propanediamide is not a drug-like molecule.
| MolName | N,N'-bis[(Z)-naphthalen-1-ylmethylideneamino]propanediamide |
| MolecularFormula | C25H20N4O2 |
| Smiles | O=C(CC(N/N=C\c1cccc2ccccc12)=O)N/N=C\c1cccc2ccccc12 |
| InChI | InChI=1S/C25H20N4O2/c30-24(28-26-16-20-11-5-9-18-7-1-3-13-22(18)20)15-25(31)29-27-17-21-12-6-10-19-8-2-4-14-23(19)21/h1-14,16-17H,15H2,(H,28,30)(H,29,31) |
| InChIK | WNVKDJNFJOOEHO-UHFFFAOYSA-N |
| TotalMolweight | 408.46 |
| Molweight | 408.46 |
| MonoisotopicMass | 408.158626 |
| CLogP | 5.3816 |
| CLogS | -7.6 |
| H Acceptors | 6 |
| H Donors | 2 |
| TotalSurfaceArea | 323.92 |
| Relative PSA | 0.22234 |
| PolarSurfaceArea | 82.92 |
| Druglikeness | 1.5105 |
| Mutagenic | none |
| Tumorigenic | high |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde |
| Shape Index | 0.6129 |
| Fragments | 1 |
| Non HAtoms | 31 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 6 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 4 |
| Aromatic Atoms | 20 |
| Sp3Atoms | 1 |
| Symmetricatoms | 15 |
| StereoCon |
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