N-[(Z)-[5-(3-chlorophenyl)furan-2-yl]methylideneamino]benzo[e][1]benzofuran-2-carboxamide
Formula:C24H15N2O3Cl
Mutagenic:high
Tumorigenic:high
Reproductive Effective:low
N-[(Z)-[5-(3-chlorophenyl)furan-2-yl]methylideneamino]benzo[e][1]benzofuran-2-carboxamide is not a drug-like molecule.
| MolName | N-[(Z)-[5-(3-chlorophenyl)furan-2-yl]methylideneamino]benzo[e][1]benzofuran-2-carboxamide |
| MolecularFormula | C24H15N2O3Cl |
| Smiles | O=C(c1cc(c2ccccc2cc2)c2o1)N/N=C\c1ccc(-c2cccc(Cl)c2)o1 |
| InChI | InChI=1S/C24H15ClN2O3/c25-17-6-3-5-16(12-17)21-11-9-18(29-21)14-26-27-24(28)23-13-20-19-7-2-1-4-15(19)8-10-22(20)30-23/h1-14H,(H,27,28) |
| InChIK | TYJQIKVDJSXSSK-UHFFFAOYSA-N |
| TotalMolweight | 414.847 |
| Molweight | 414.847 |
| MonoisotopicMass | 414.07712 |
| CLogP | 6.4465 |
| CLogS | -8.706 |
| H Acceptors | 5 |
| H Donors | 1 |
| TotalSurfaceArea | 310.75 |
| Relative PSA | 0.20669 |
| PolarSurfaceArea | 67.74 |
| Druglikeness | 6.6757 |
| Mutagenic | high |
| Tumorigenic | high |
| Reproductive Effective | low |
| Irritant | none |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde |
| Shape Index | 0.6 |
| Fragments | 1 |
| Non HAtoms | 30 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 4 |
| Rings Closures | 5 |
| Small Rings | 5 |
| Aromatic Rings | 5 |
| Aromatic Atoms | 24 |
| StereoCon |
Click to Load Molecule:
1 - N-[(Z)-[5-(3-chlorophenyl)furan-2-yl]methylideneamino]benzo[e][1]benzofuran-2-carboxamide | 2 - N-[(Z)-[5-(3-chlorophenyl)furan-2-yl]methylideneamino]benzo[e][1]benzofuran-2-carboxamide
Spacefill |
Wire |
Ball & Stick |
Iso-vdw |
Opaque |
Dot Surface |
Mep |
Translucent |
Spin |
Label On |
Off