(2E)-N-(4-chlorophenyl)-2-[(3,4-dichlorophenyl)diazenyl]-2-[(3,4-dichlorophenyl)hydrazinylidene]acetamide
Formula:C20H12N5OCl5
Mutagenic:low
Tumorigenic:high
Reproductive Effective:low
(2E)-N-(4-chlorophenyl)-2-[(3,4-dichlorophenyl)diazenyl]-2-[(3,4-dichlorophenyl)hydrazinylidene]acetamide is not a drug-like molecule.
| MolName | (2E)-N-(4-chlorophenyl)-2-[(3,4-dichlorophenyl)diazenyl]-2-[(3,4-dichlorophenyl)hydrazinylidene]acetamide |
| MolecularFormula | C20H12N5OCl5 |
| Smiles | O=C(/C(/N=N/c(cc1)cc(Cl)c1Cl)=N\Nc(cc1)cc(Cl)c1Cl)Nc(cc1)ccc1Cl |
| InChI | InChI=1S/C20H12Cl5N5O/c21-11-1-3-12(4-2-11)26-20(31)19(29-27-13-5-7-15(22)17(24)9-13)30-28-14-6-8-16(23)18(25)10-14/h1-10,27H,(H,26,31) |
| InChIK | AUDGLMMVURLJQL-UHFFFAOYSA-N |
| TotalMolweight | 515.614 |
| Molweight | 515.614 |
| MonoisotopicMass | 512.948445 |
| CLogP | 8.5274 |
| CLogS | -8.442 |
| H Acceptors | 6 |
| H Donors | 2 |
| TotalSurfaceArea | 356.54 |
| Relative PSA | 0.19771 |
| PolarSurfaceArea | 78.21 |
| Druglikeness | -0.80411 |
| Mutagenic | low |
| Tumorigenic | high |
| Reproductive Effective | low |
| Irritant | none |
| Nasty Functions | azo |
| Shape Index | 0.48387 |
| Fragments | 1 |
| Non HAtoms | 31 |
| NonCHAtoms | 11 |
| Electronegative Atoms | 11 |
| Rotatable Bond | 5 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Symmetricatoms | 2 |
| Amides | 1 |
| StereoCon |
Click to Load Molecule:
1 - (2E)-N-(4-chlorophenyl)-2-[(3,4-dichlorophenyl)diazenyl]-2-[(3,4-dichlorophenyl)hydrazinylidene]acetamide | 2 - (2E)-N-(4-chlorophenyl)-2-[(3,4-dichlorophenyl)diazenyl]-2-[(3,4-dichlorophenyl)hydrazinylidene]acetamide
Spacefill |
Wire |
Ball & Stick |
Iso-vdw |
Opaque |
Dot Surface |
Mep |
Translucent |
Spin |
Label On |
Off