| MolName | N'-[(Z)-(3-methoxyphenyl)methylideneamino]-N-[2-[(3-methylphenyl)carbamoyl]phenyl]oxamide |
| MolecularFormula | C24H22N4O4 |
| Smiles | Cc1cccc(NC(c(cccc2)c2NC(C(N/N=C\c2cc(OC)ccc2)=O)=O)=O)c1 |
| InChI | InChI=1S/C24H22N4O4/c1-16-7-5-9-18(13-16)26-22(29)20-11-3-4-12-21(20)27-23(30)24(31)28-25-15-17-8-6-10-19(14-17)32-2/h3-15H,1-2H3,(H,26,29)(H,27,30)(H,28,31) |
| InChIK | CAXJLFVWCOVEBT-UHFFFAOYSA-N |
| TotalMolweight | 430.463 |
| Molweight | 430.463 |
| MonoisotopicMass | 430.164106 |
| CLogP | 3.5653 |
| CLogS | -5.399 |
| H Acceptors | 8 |
| H Donors | 3 |
| TotalSurfaceArea | 339.69 |
| Relative PSA | 0.2797 |
| PolarSurfaceArea | 108.89 |
| Druglikeness | 3.5922 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde; limit! oxal-diamide |
| Shape Index | 0.59375 |
| Fragments | 1 |
| Non HAtoms | 32 |
| NonCHAtoms | 8 |
| Electronegative Atoms | 8 |
| Rotatable Bond | 7 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 3 |
| Amides | 2 |
| StereoCon |
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1 - N'-[(Z)-(3-methoxyphenyl)methylideneamino]-N-[2-[(3-methylphenyl)carbamoyl]phenyl]oxamide | 2 - N'-[(Z)-(3-methoxyphenyl)methylideneamino]-N-[2-[(3-methylphenyl)carbamoyl]phenyl]oxamide