(Z)-N-[4-[(4-nitrophenyl)diazenyl]phenyl]benzenecarbohydrazonoyl chloride
Formula:C19H14N5O2Cl
Mutagenic:high
Tumorigenic:high
Reproductive Effective:high
(Z)-N-[4-[(4-nitrophenyl)diazenyl]phenyl]benzenecarbohydrazonoyl chloride is not a drug-like molecule.
| MolName | (Z)-N-[4-[(4-nitrophenyl)diazenyl]phenyl]benzenecarbohydrazonoyl chloride |
| MolecularFormula | C19H14N5O2Cl |
| Smiles | [O-][N+](c(cc1)ccc1/N=N/c(cc1)ccc1N/N=C(/c1ccccc1)\Cl)=O |
| InChI | InChI=1S/C19H14ClN5O2/c20-19(14-4-2-1-3-5-14)24-23-16-8-6-15(7-9-16)21-22-17-10-12-18(13-11-17)25(26)27/h1-13,23H |
| InChIK | VUIGHRCMFZTIND-UHFFFAOYSA-N |
| TotalMolweight | 379.806 |
| Molweight | 379.806 |
| MonoisotopicMass | 379.083602 |
| CLogP | 6.1114 |
| CLogS | -7.123 |
| H Acceptors | 7 |
| H Donors | 1 |
| TotalSurfaceArea | 289.32 |
| Relative PSA | 0.2641 |
| PolarSurfaceArea | 94.93 |
| Druglikeness | -8.9558 |
| Mutagenic | high |
| Tumorigenic | high |
| Reproductive Effective | high |
| Irritant | none |
| Nasty Functions | acyl-halogenide type; allyl/benzyl chloride; aromatic nitro; azo |
| Shape Index | 0.7037 |
| Fragments | 1 |
| Non HAtoms | 27 |
| NonCHAtoms | 8 |
| Electronegative Atoms | 8 |
| Rotatable Bond | 6 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 1 |
| Symmetricatoms | 6 |
| AcidicOxygens | 1 |
| StereoCon |
Click to Load Molecule:
1 - (Z)-N-[4-[(4-nitrophenyl)diazenyl]phenyl]benzenecarbohydrazonoyl chloride | 2 - (Z)-N-[4-[(4-nitrophenyl)diazenyl]phenyl]benzenecarbohydrazonoyl chloride
Spacefill |
Wire |
Ball & Stick |
Iso-vdw |
Opaque |
Dot Surface |
Mep |
Translucent |
Spin |
Label On |
Off