(2Z)-2-[(E)-(2-hydroxyphenyl)methylidenehydrazinylidene]-1,2-diphenylethanone

C21H16N2O2 — CID 135445495

IUPAC(2Z)-2-[(E)-(2-hydroxyphenyl)methylidenehydrazinylidene]-1,2-diphenylethanone
SMILESO=C(/C(=N\N=C\c1ccccc1O)c1ccccc1)c1ccccc1
InChIInChI=1S/C21H16N2O2/c24-19-14-8-7-13-18(19)15-22-23-20(16-9-3-1-4-10-16)21(25)17-11-5-2-6-12-17/h1-15,24H/b22-15+,23-20-
InChIKeyGBEHFRQBHHPILT-GNMMUHOESA-N
MW328.37 g/mol
LogP4.10
Rot. Bonds5

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

(2Z)-2-[(E)-(2-hydroxyphenyl)methylidenehydrazinylidene]-1,2-diphenylethanone (PubChem CID 135445495) has the molecular formula C21H16N2O2 and a molecular weight of 328.37 g/mol. Its IUPAC name is (2Z)-2-[(E)-(2-hydroxyphenyl)methylidenehydrazinylidene]-1,2-diphenylethanone.

Molecular Properties

Compound Name(2Z)-2-[(E)-(2-hydroxyphenyl)methylidenehydrazinylidene]-1,2-diphenylethanone
PubChem CID135445495
Molecular FormulaC21H16N2O2
Molecular Weight328.37 g/mol
Exact Mass328.12
IUPAC Name(2Z)-2-[(E)-(2-hydroxyphenyl)methylidenehydrazinylidene]-1,2-diphenylethanone
SMILESO=C(/C(=N\N=C\c1ccccc1O)c1ccccc1)c1ccccc1
InChIInChI=1S/C21H16N2O2/c24-19-14-8-7-13-18(19)15-22-23-20(16-9-3-1-4-10-16)21(25)17-11-5-2-6-12-17/h1-15,24H/b22-15+,23-20-
InChIKeyGBEHFRQBHHPILT-GNMMUHOESA-N
XLogP4.10
TPSA62.02 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.37
LogP ≤ 54.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hzone_phenol_A(479)', 'substructure': 'N/A'}, {'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'}

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Related Compounds

(2E)-1,2-diphenyl-2-[(E)-(2,3,4-trihydroxyphenyl)methylidenehydrazinylidene]ethanone
CID 135401318
(2E)-2-[(E)-(3,4-dihydroxyphenyl)methylidenehydrazinylidene]-1,2-diphenylethanone
CID 135521592
(2Z)-2-[(Z)-(2-hydroxynaphthalen-1-yl)methylidenehydrazinylidene]-1,2-diphenylethanone
CID 135884923
2-{(E)-[(diphenylmethylidene)hydrazinylidene]methyl}phenol
CID 135541809
2-((e)-(5-Bromo-2-hydroxybenzylidene)hydrazono)-1,2-diphenylethanone
CID 135676015
3-Benzylimino-3-(2-hydroxyphenyl)-1-phenylpropan-1-one
CID 136654790
1-Hydroxy-9,10-anthraquinone-9-propylimine
CID 137209055
(z)-2-((e)-(5-Bromo-2-hydroxybenzylidene)hydrazono)-1,2-diphenyl-ethanone
CID 137306450
2-[[2-(Difluoromethoxy)phenyl]methylidenehydrazinylidene]-1,2-diphenylethanone
CID 3648431
(2Z)-2-[(E)-1-(5-fluoro-2-hydroxyphenyl)ethylidenehydrazinylidene]-1,2-diphenylethanone
CID 135775351
(2Z)-2-[(E)-1-(5-fluoro-2-hydroxyphenyl)propylidenehydrazinylidene]-1,2-diphenylethanone
CID 135775354
(2Z)-2-[(2-hydroxynaphthalen-1-yl)methylidenehydrazinylidene]-1,2-diphenylethanone
CID 172917697

Frequently Asked Questions

What is the IUPAC name of (2Z)-2-[(E)-(2-hydroxyphenyl)methylidenehydrazinylidene]-1,2-diphenylethanone?
The IUPAC name of (2Z)-2-[(E)-(2-hydroxyphenyl)methylidenehydrazinylidene]-1,2-diphenylethanone (CID 135445495) is (2Z)-2-[(E)-(2-hydroxyphenyl)methylidenehydrazinylidene]-1,2-diphenylethanone.
What is the SMILES notation for (2Z)-2-[(E)-(2-hydroxyphenyl)methylidenehydrazinylidene]-1,2-diphenylethanone?
The canonical SMILES for (2Z)-2-[(E)-(2-hydroxyphenyl)methylidenehydrazinylidene]-1,2-diphenylethanone is O=C(/C(=N\N=C\c1ccccc1O)c1ccccc1)c1ccccc1.
What is the InChIKey of (2Z)-2-[(E)-(2-hydroxyphenyl)methylidenehydrazinylidene]-1,2-diphenylethanone?
The InChIKey is GBEHFRQBHHPILT-GNMMUHOESA-N. The full InChI is InChI=1S/C21H16N2O2/c24-19-14-8-7-13-18(19)15-22-23-20(16-9-3-1-4-10-16)21(25)17-11-5-2-6-12-17/h1-15,24H/b22-15+,23-20-.
What are the key properties of (2Z)-2-[(E)-(2-hydroxyphenyl)methylidenehydrazinylidene]-1,2-diphenylethanone?
(2Z)-2-[(E)-(2-hydroxyphenyl)methylidenehydrazinylidene]-1,2-diphenylethanone has a molecular weight of 328.37 g/mol, XLogP of 4.10, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2Z)-2-[(E)-(2-hydroxyphenyl)methylidenehydrazinylidene]-1,2-diphenylethanone is sourced from PubChem (CID 135445495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).