2-[(3-fluoro-4-hydroxyphenyl)methylidenehydrazinylidene]-1,3-thiazolidin-4-one

C10H8FN3O2S — CID 168575880

IUPAC2-[(3-fluoro-4-hydroxyphenyl)methylidenehydrazinylidene]-1,3-thiazolidin-4-one
SMILESO=C1CSC(=NN=Cc2ccc(O)c(F)c2)N1
InChIInChI=1S/C10H8FN3O2S/c11-7-3-6(1-2-8(7)15)4-12-14-10-13-9(16)5-17-10/h1-4,15H,5H2,(H,13,14,16)
InChIKeyJYXWTFDXXRBNJL-UHFFFAOYSA-N
MW253.26 g/mol
LogP1.08
Rot. Bonds2

About 2-[(3-fluoro-4-hydroxyphenyl)methylidenehydrazinylidene]-1,3-thiazolidin-4-one

2-[(3-fluoro-4-hydroxyphenyl)methylidenehydrazinylidene]-1,3-thiazolidin-4-one (PubChem CID 168575880) has the molecular formula C10H8FN3O2S and a molecular weight of 253.26 g/mol. Its IUPAC name is 2-[(3-fluoro-4-hydroxyphenyl)methylidenehydrazinylidene]-1,3-thiazolidin-4-one.

Molecular Properties

Compound Name2-[(3-fluoro-4-hydroxyphenyl)methylidenehydrazinylidene]-1,3-thiazolidin-4-one
PubChem CID168575880
Molecular FormulaC10H8FN3O2S
Molecular Weight253.26 g/mol
Exact Mass253.03
IUPAC Name2-[(3-fluoro-4-hydroxyphenyl)methylidenehydrazinylidene]-1,3-thiazolidin-4-one
SMILESO=C1CSC(=NN=Cc2ccc(O)c(F)c2)N1
InChIInChI=1S/C10H8FN3O2S/c11-7-3-6(1-2-8(7)15)4-12-14-10-13-9(16)5-17-10/h1-4,15H,5H2,(H,13,14,16)
InChIKeyJYXWTFDXXRBNJL-UHFFFAOYSA-N
XLogP1.08
TPSA74.05 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.26
LogP ≤ 51.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'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 2-[(3-fluoro-4-hydroxyphenyl)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)-5-[(4-fluorophenyl)methyl]-2-[(E)-(2-hydroxyphenyl)methylidenehydrazinylidene]-1,3-thiazolidin-4-one
CID 135856001
(2Z)-5-benzyl-2-[(2E)-(4-hydroxybenzylidene)hydrazinylidene]-1,3-thiazolidin-4-one
CID 135645326
(2E)-2-[(E)-(5-fluoro-2-hydroxyphenyl)methylidenehydrazinylidene]-1,3-thiazolidin-4-one
CID 136066070
(2E)-2-[(2E)-(4-methoxybenzylidene)hydrazinylidene]-1,3-thiazolidin-4-one
CID 135419868
(E)-2-((E)-(4-hydroxybenzylidene)hydrazono)thiazolidin-4-one
CID 135886854
(E)-2-((E)-(3-Chloro-4-hydroxybenzylideno)thiazolidin-4-one (3)
CID 137014973
2-Hydroxybenzaldehyde (4-oxo-4,5-dihydro-1,3-thiazol-2-yl)hydrazone
CID 135403953
(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
(2E)-2-[(Z)-(2,4-dihydroxyphenyl)methylidenehydrazinylidene]-1,3-thiazolidin-4-one
CID 135672197
2-[(2-Hydroxy-benzylidene)-hydrazono]-thiazolidin-4-one
CID 135419502
5-[(4-Fluorophenyl)methyl]-2-[(2-hydroxyphenyl)methylidenehydrazinylidene]-1,3-thiazolidin-4-one
CID 135484728

Frequently Asked Questions

What is the IUPAC name of 2-[(3-fluoro-4-hydroxyphenyl)methylidenehydrazinylidene]-1,3-thiazolidin-4-one?
The IUPAC name of 2-[(3-fluoro-4-hydroxyphenyl)methylidenehydrazinylidene]-1,3-thiazolidin-4-one (CID 168575880) is 2-[(3-fluoro-4-hydroxyphenyl)methylidenehydrazinylidene]-1,3-thiazolidin-4-one.
What is the SMILES notation for 2-[(3-fluoro-4-hydroxyphenyl)methylidenehydrazinylidene]-1,3-thiazolidin-4-one?
The canonical SMILES for 2-[(3-fluoro-4-hydroxyphenyl)methylidenehydrazinylidene]-1,3-thiazolidin-4-one is O=C1CSC(=NN=Cc2ccc(O)c(F)c2)N1.
What is the InChIKey of 2-[(3-fluoro-4-hydroxyphenyl)methylidenehydrazinylidene]-1,3-thiazolidin-4-one?
The InChIKey is JYXWTFDXXRBNJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8FN3O2S/c11-7-3-6(1-2-8(7)15)4-12-14-10-13-9(16)5-17-10/h1-4,15H,5H2,(H,13,14,16).
What are the key properties of 2-[(3-fluoro-4-hydroxyphenyl)methylidenehydrazinylidene]-1,3-thiazolidin-4-one?
2-[(3-fluoro-4-hydroxyphenyl)methylidenehydrazinylidene]-1,3-thiazolidin-4-one has a molecular weight of 253.26 g/mol, XLogP of 1.08, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-fluoro-4-hydroxyphenyl)methylidenehydrazinylidene]-1,3-thiazolidin-4-one is sourced from PubChem (CID 168575880), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).