(2Z)-2-[(E)-benzylidenehydrazinylidene]-1,2-diphenylethanone

C21H16N2O — CID 6908437

IUPAC(2Z)-2-[(E)-benzylidenehydrazinylidene]-1,2-diphenylethanone
SMILESO=C(/C(=N\N=C\c1ccccc1)c1ccccc1)c1ccccc1
InChIInChI=1S/C21H16N2O/c24-21(19-14-8-3-9-15-19)20(18-12-6-2-7-13-18)23-22-16-17-10-4-1-5-11-17/h1-16H/b22-16+,23-20-
InChIKeyXFSKNGLQBGHAIV-QGANTCJASA-N
MW312.37 g/mol
LogP4.39
Rot. Bonds5

About (2Z)-2-[(E)-benzylidenehydrazinylidene]-1,2-diphenylethanone

(2Z)-2-[(E)-benzylidenehydrazinylidene]-1,2-diphenylethanone (PubChem CID 6908437) has the molecular formula C21H16N2O and a molecular weight of 312.37 g/mol. Its IUPAC name is (2Z)-2-[(E)-benzylidenehydrazinylidene]-1,2-diphenylethanone.

Molecular Properties

Compound Name(2Z)-2-[(E)-benzylidenehydrazinylidene]-1,2-diphenylethanone
PubChem CID6908437
Molecular FormulaC21H16N2O
Molecular Weight312.37 g/mol
Exact Mass312.13
IUPAC Name(2Z)-2-[(E)-benzylidenehydrazinylidene]-1,2-diphenylethanone
SMILESO=C(/C(=N\N=C\c1ccccc1)c1ccccc1)c1ccccc1
InChIInChI=1S/C21H16N2O/c24-21(19-14-8-3-9-15-19)20(18-12-6-2-7-13-18)23-22-16-17-10-4-1-5-11-17/h1-16H/b22-16+,23-20-
InChIKeyXFSKNGLQBGHAIV-QGANTCJASA-N
XLogP4.39
TPSA41.79 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.37
LogP ≤ 54.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_one_A(321)', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze (2Z)-2-[(E)-benzylidenehydrazinylidene]-1,2-diphenylethanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (2Z)-2-[(E)-benzylidenehydrazinylidene]-1,2-diphenylethanone?
The IUPAC name of (2Z)-2-[(E)-benzylidenehydrazinylidene]-1,2-diphenylethanone (CID 6908437) is (2Z)-2-[(E)-benzylidenehydrazinylidene]-1,2-diphenylethanone.
What is the SMILES notation for (2Z)-2-[(E)-benzylidenehydrazinylidene]-1,2-diphenylethanone?
The canonical SMILES for (2Z)-2-[(E)-benzylidenehydrazinylidene]-1,2-diphenylethanone is O=C(/C(=N\N=C\c1ccccc1)c1ccccc1)c1ccccc1.
What is the InChIKey of (2Z)-2-[(E)-benzylidenehydrazinylidene]-1,2-diphenylethanone?
The InChIKey is XFSKNGLQBGHAIV-QGANTCJASA-N. The full InChI is InChI=1S/C21H16N2O/c24-21(19-14-8-3-9-15-19)20(18-12-6-2-7-13-18)23-22-16-17-10-4-1-5-11-17/h1-16H/b22-16+,23-20-.
What are the key properties of (2Z)-2-[(E)-benzylidenehydrazinylidene]-1,2-diphenylethanone?
(2Z)-2-[(E)-benzylidenehydrazinylidene]-1,2-diphenylethanone has a molecular weight of 312.37 g/mol, XLogP of 4.39, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2Z)-2-[(E)-benzylidenehydrazinylidene]-1,2-diphenylethanone is sourced from PubChem (CID 6908437), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).