(2Z)-2-[(Z)-[carboxy(phenyl)methylidene]hydrazinylidene]-2-phenylacetic acid

C16H12N2O4 — CID 15184953

IUPAC(2Z)-2-[(Z)-[carboxy(phenyl)methylidene]hydrazinylidene]-2-phenylacetic acid
SMILESO=C(O)/C(=N\N=C(/C(=O)O)c1ccccc1)c1ccccc1
InChIInChI=1S/C16H12N2O4/c19-15(20)13(11-7-3-1-4-8-11)17-18-14(16(21)22)12-9-5-2-6-10-12/h1-10H,(H,19,20)(H,21,22)/b17-13-,18-14-
InChIKeyOYBBSOSYBGFVDI-JTFWXBGUSA-N
MW296.28 g/mol
LogP2.05
Rot. Bonds5

About (2Z)-2-[(Z)-[carboxy(phenyl)methylidene]hydrazinylidene]-2-phenylacetic acid

(2Z)-2-[(Z)-[carboxy(phenyl)methylidene]hydrazinylidene]-2-phenylacetic acid (PubChem CID 15184953) has the molecular formula C16H12N2O4 and a molecular weight of 296.28 g/mol. Its IUPAC name is (2Z)-2-[(Z)-[carboxy(phenyl)methylidene]hydrazinylidene]-2-phenylacetic acid.

Molecular Properties

Compound Name(2Z)-2-[(Z)-[carboxy(phenyl)methylidene]hydrazinylidene]-2-phenylacetic acid
PubChem CID15184953
Molecular FormulaC16H12N2O4
Molecular Weight296.28 g/mol
Exact Mass296.08
IUPAC Name(2Z)-2-[(Z)-[carboxy(phenyl)methylidene]hydrazinylidene]-2-phenylacetic acid
SMILESO=C(O)/C(=N\N=C(/C(=O)O)c1ccccc1)c1ccccc1
InChIInChI=1S/C16H12N2O4/c19-15(20)13(11-7-3-1-4-8-11)17-18-14(16(21)22)12-9-5-2-6-10-12/h1-10H,(H,19,20)(H,21,22)/b17-13-,18-14-
InChIKeyOYBBSOSYBGFVDI-JTFWXBGUSA-N
XLogP2.05
TPSA99.32 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.28
LogP ≤ 52.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze (2Z)-2-[(Z)-[carboxy(phenyl)methylidene]hydrazinylidene]-2-phenylacetic acid with MolForge

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

Launch Full Analysis

Related Compounds

(8E)-8-hydroxyimino-8-(4-phenylphenyl)octanoic acid
CID 44329444
2-benzylidene-4-phenyl-1,3-oxazol-5(2H)-one
CID 851756
(4Z)-4-phenyl-4-[4-[(E)-1-phenylethylideneamino]oxybutoxyimino]butanoic acid
CID 46229742
(2E)-2-(diaminomethylidenehydrazinylidene)-2-phenylacetic acid
CID 10798307
Benzeneacetic acid, alpha-diazo-, methyl ester
CID 53436974
2-(Benzyloxyimino)-2-phenylacetic acid
CID 6163621
2-[3-[(Z)-N-hydroxy-C-phenylcarbonimidoyl]phenyl]propanoic acid
CID 11851123
(2Z)-2-[3-[(Z)-C-carboxy-N-hydroxycarbonimidoyl]phenyl]-2-hydroxyiminoacetic acid
CID 44446347
(2Z)-2-hydrazinylidene-3-phenylpropanoic acid
CID 127047861
2-Benzylidene-4-phenyl-5(2h)-oxazolone
CID 11842096
3,4-diphenyl-5(4H)-isoxazolone
CID 12486396
Methyl 2-methoxyimino-2-phenylacetate
CID 577152

Frequently Asked Questions

What is the IUPAC name of (2Z)-2-[(Z)-[carboxy(phenyl)methylidene]hydrazinylidene]-2-phenylacetic acid?
The IUPAC name of (2Z)-2-[(Z)-[carboxy(phenyl)methylidene]hydrazinylidene]-2-phenylacetic acid (CID 15184953) is (2Z)-2-[(Z)-[carboxy(phenyl)methylidene]hydrazinylidene]-2-phenylacetic acid.
What is the SMILES notation for (2Z)-2-[(Z)-[carboxy(phenyl)methylidene]hydrazinylidene]-2-phenylacetic acid?
The canonical SMILES for (2Z)-2-[(Z)-[carboxy(phenyl)methylidene]hydrazinylidene]-2-phenylacetic acid is O=C(O)/C(=N\N=C(/C(=O)O)c1ccccc1)c1ccccc1.
What is the InChIKey of (2Z)-2-[(Z)-[carboxy(phenyl)methylidene]hydrazinylidene]-2-phenylacetic acid?
The InChIKey is OYBBSOSYBGFVDI-JTFWXBGUSA-N. The full InChI is InChI=1S/C16H12N2O4/c19-15(20)13(11-7-3-1-4-8-11)17-18-14(16(21)22)12-9-5-2-6-10-12/h1-10H,(H,19,20)(H,21,22)/b17-13-,18-14-.
What are the key properties of (2Z)-2-[(Z)-[carboxy(phenyl)methylidene]hydrazinylidene]-2-phenylacetic acid?
(2Z)-2-[(Z)-[carboxy(phenyl)methylidene]hydrazinylidene]-2-phenylacetic acid has a molecular weight of 296.28 g/mol, XLogP of 2.05, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2Z)-2-[(Z)-[carboxy(phenyl)methylidene]hydrazinylidene]-2-phenylacetic acid is sourced from PubChem (CID 15184953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).