(2Z)-2-[(2,4-dinitrophenyl)hydrazinylidene]-1,2-diphenylethanone
Formula:C20H14N4O5
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(2Z)-2-[(2,4-dinitrophenyl)hydrazinylidene]-1,2-diphenylethanone is a drug-like molecule.
| MolName | (2Z)-2-[(2,4-dinitrophenyl)hydrazinylidene]-1,2-diphenylethanone |
| MolecularFormula | C20H14N4O5 |
| Smiles | [O-][N+](c(cc1)cc([N+]([O-])=O)c1N/N=C(\C(c1ccccc1)=O)/c1ccccc1)=O |
| InChI | InChI=1S/C20H14N4O5/c25-20(15-9-5-2-6-10-15)19(14-7-3-1-4-8-14)22-21-17-12-11-16(23(26)27)13-18(17)24(28)29/h1-13,21H |
| InChIK | ODXUDQOXIGERFQ-UHFFFAOYSA-N |
| TotalMolweight | 390.354 |
| Molweight | 390.354 |
| MonoisotopicMass | 390.096421 |
| CLogP | 3.4892 |
| CLogS | -5.745 |
| H Acceptors | 9 |
| H Donors | 1 |
| TotalSurfaceArea | 292.3 |
| Relative PSA | 0.33134 |
| PolarSurfaceArea | 133.1 |
| Druglikeness | -2.9092 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | aromatic nitro |
| Shape Index | 0.48276 |
| Fragments | 1 |
| Non HAtoms | 29 |
| NonCHAtoms | 9 |
| Electronegative Atoms | 9 |
| Rotatable Bond | 7 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 2 |
| Symmetricatoms | 4 |
| AcidicOxygens | 2 |
| StereoCon |
Click to Load Molecule:
1 - (2Z)-2-[(2,4-dinitrophenyl)hydrazinylidene]-1,2-diphenylethanone | 2 - (2Z)-2-[(2,4-dinitrophenyl)hydrazinylidene]-1,2-diphenylethanone
Spacefill |
Wire |
Ball & Stick |
Iso-vdw |
Opaque |
Dot Surface |
Mep |
Translucent |
Spin |
Label On |
Off