(2E)-2-[(Z)-(2,4-dihydroxyphenyl)methylidenehydrazinylidene]-1,3-thiazolidin-4-one

C10H9N3O3S — CID 135672197

IUPAC(2E)-2-[(Z)-(2,4-dihydroxyphenyl)methylidenehydrazinylidene]-1,3-thiazolidin-4-one
SMILESO=C1CS/C(=N/N=C\c2ccc(O)cc2O)N1
InChIInChI=1S/C10H9N3O3S/c14-7-2-1-6(8(15)3-7)4-11-13-10-12-9(16)5-17-10/h1-4,14-15H,5H2,(H,12,13,16)/b11-4-
InChIKeyZLVJRXQFAACFPJ-WCIBSUBMSA-N
MW251.27 g/mol
LogP0.65
Rot. Bonds2

About (2E)-2-[(Z)-(2,4-dihydroxyphenyl)methylidenehydrazinylidene]-1,3-thiazolidin-4-one

(2E)-2-[(Z)-(2,4-dihydroxyphenyl)methylidenehydrazinylidene]-1,3-thiazolidin-4-one (PubChem CID 135672197) has the molecular formula C10H9N3O3S and a molecular weight of 251.27 g/mol. Its IUPAC name is (2E)-2-[(Z)-(2,4-dihydroxyphenyl)methylidenehydrazinylidene]-1,3-thiazolidin-4-one.

Molecular Properties

Compound Name(2E)-2-[(Z)-(2,4-dihydroxyphenyl)methylidenehydrazinylidene]-1,3-thiazolidin-4-one
PubChem CID135672197
Molecular FormulaC10H9N3O3S
Molecular Weight251.27 g/mol
Exact Mass251.04
IUPAC Name(2E)-2-[(Z)-(2,4-dihydroxyphenyl)methylidenehydrazinylidene]-1,3-thiazolidin-4-one
SMILESO=C1CS/C(=N/N=C\c2ccc(O)cc2O)N1
InChIInChI=1S/C10H9N3O3S/c14-7-2-1-6(8(15)3-7)4-11-13-10-12-9(16)5-17-10/h1-4,14-15H,5H2,(H,12,13,16)/b11-4-
InChIKeyZLVJRXQFAACFPJ-WCIBSUBMSA-N
XLogP0.65
TPSA94.28 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.27
LogP ≤ 50.65
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hzone_phenol_A(479)', 'substructure': 'N/A'}, {'alert_name': 'hzone_phenol_B(215)', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze (2E)-2-[(Z)-(2,4-dihydroxyphenyl)methylidenehydrazinylidene]-1,3-thiazolidin-4-one 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

{(2Z)-2-[(2E)-(2,4-dihydroxybenzylidene)hydrazinylidene]-3-methyl-4-oxo-1,3-thiazolidin-5-yl}acetic acid
CID 135650747
(2E)-2-[(E)-(5-fluoro-2-hydroxyphenyl)methylidenehydrazinylidene]-1,3-thiazolidin-4-one
CID 136066070
(E)-2-((E)-(4-hydroxybenzylidene)hydrazono)thiazolidin-4-one
CID 135886854
2-Hydroxybenzaldehyde (4-oxo-4,5-dihydro-1,3-thiazol-2-yl)hydrazone
CID 135403953
(Z)-2-((Z)-(2,4-Dimethoxybenzoylidine)hydrazono)thiazolidine-4-one (18)
CID 136087459
(E)-2((E)-(4-Hydroxybenzylidin)hydrazono)thiazolidine-4-one (6)
CID 137014974
2-[(2E)-2-[(3-hydroxyphenyl)methylidene]hydrazinyl]-1,3-thiazol-4-one
CID 135504330
2-[(2-Hydroxy-benzylidene)-hydrazono]-thiazolidin-4-one
CID 135419502
(2Z)-2-[(2E)-(4-hydroxybenzylidene)hydrazinylidene]-1,3-thiazolidin-4-one
CID 135454341
(5Z)-5-[(2,4-dihydroxyphenyl)methylidene]-2-imino-1,3-thiazolidin-4-one
CID 137629308
2-[(E)-(4-hydroxyphenyl)methylidenehydrazinylidene]-1,3-thiazolidin-4-one
CID 137221018
4-Hydroxybenzaldehyde (5-isopropyl-4-oxo-4,5-dihydro-1,3-thiazol-2-yl)hydrazone
CID 135523728

Frequently Asked Questions

What is the IUPAC name of (2E)-2-[(Z)-(2,4-dihydroxyphenyl)methylidenehydrazinylidene]-1,3-thiazolidin-4-one?
The IUPAC name of (2E)-2-[(Z)-(2,4-dihydroxyphenyl)methylidenehydrazinylidene]-1,3-thiazolidin-4-one (CID 135672197) is (2E)-2-[(Z)-(2,4-dihydroxyphenyl)methylidenehydrazinylidene]-1,3-thiazolidin-4-one.
What is the SMILES notation for (2E)-2-[(Z)-(2,4-dihydroxyphenyl)methylidenehydrazinylidene]-1,3-thiazolidin-4-one?
The canonical SMILES for (2E)-2-[(Z)-(2,4-dihydroxyphenyl)methylidenehydrazinylidene]-1,3-thiazolidin-4-one is O=C1CS/C(=N/N=C\c2ccc(O)cc2O)N1.
What is the InChIKey of (2E)-2-[(Z)-(2,4-dihydroxyphenyl)methylidenehydrazinylidene]-1,3-thiazolidin-4-one?
The InChIKey is ZLVJRXQFAACFPJ-WCIBSUBMSA-N. The full InChI is InChI=1S/C10H9N3O3S/c14-7-2-1-6(8(15)3-7)4-11-13-10-12-9(16)5-17-10/h1-4,14-15H,5H2,(H,12,13,16)/b11-4-.
What are the key properties of (2E)-2-[(Z)-(2,4-dihydroxyphenyl)methylidenehydrazinylidene]-1,3-thiazolidin-4-one?
(2E)-2-[(Z)-(2,4-dihydroxyphenyl)methylidenehydrazinylidene]-1,3-thiazolidin-4-one has a molecular weight of 251.27 g/mol, XLogP of 0.65, 2 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (2E)-2-[(Z)-(2,4-dihydroxyphenyl)methylidenehydrazinylidene]-1,3-thiazolidin-4-one is sourced from PubChem (CID 135672197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).