N-[(Z)-furan-2-ylmethylideneamino]-4-[(2-phenylphenoxy)methyl]benzamide
Formula:C25H20N2O3
Mutagenic:high
Tumorigenic:none
Reproductive Effective:none
N-[(Z)-furan-2-ylmethylideneamino]-4-[(2-phenylphenoxy)methyl]benzamide is not a drug-like molecule.
| MolName | N-[(Z)-furan-2-ylmethylideneamino]-4-[(2-phenylphenoxy)methyl]benzamide |
| MolecularFormula | C25H20N2O3 |
| Smiles | O=C(c1ccc(COc(cccc2)c2-c2ccccc2)cc1)N/N=C\c1ccco1 |
| InChI | InChI=1S/C25H20N2O3/c28-25(27-26-17-22-9-6-16-29-22)21-14-12-19(13-15-21)18-30-24-11-5-4-10-23(24)20-7-2-1-3-8-20/h1-17H,18H2,(H,27,28) |
| InChIK | RIZNOSMZBRDJRC-UHFFFAOYSA-N |
| TotalMolweight | 396.445 |
| Molweight | 396.445 |
| MonoisotopicMass | 396.147393 |
| CLogP | 5.3976 |
| CLogS | -6.83 |
| H Acceptors | 5 |
| H Donors | 1 |
| TotalSurfaceArea | 319.96 |
| Relative PSA | 0.1879 |
| PolarSurfaceArea | 63.83 |
| Druglikeness | 3.9633 |
| Mutagenic | high |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde |
| Shape Index | 0.63333 |
| Fragments | 1 |
| Non HAtoms | 30 |
| NonCHAtoms | 5 |
| Electronegative Atoms | 5 |
| Rotatable Bond | 7 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 4 |
| Aromatic Atoms | 23 |
| Sp3Atoms | 2 |
| Symmetricatoms | 4 |
| StereoCon |
Click to Load Molecule:
1 - N-[(Z)-furan-2-ylmethylideneamino]-4-[(2-phenylphenoxy)methyl]benzamide | 2 - N-[(Z)-furan-2-ylmethylideneamino]-4-[(2-phenylphenoxy)methyl]benzamide
Spacefill |
Wire |
Ball & Stick |
Iso-vdw |
Opaque |
Dot Surface |
Mep |
Translucent |
Spin |
Label On |
Off