(5Z)-5-benzylidene-2-(4-hydroxyphenyl)imino-1,3-thiazolidin-4-one

C16H12N2O2S — CID 135437758

IUPAC(5Z)-5-benzylidene-2-(4-hydroxyphenyl)imino-1,3-thiazolidin-4-one
SMILESO=C1N/C(=N\c2ccc(O)cc2)S/C1=C\c1ccccc1
InChIInChI=1S/C16H12N2O2S/c19-13-8-6-12(7-9-13)17-16-18-15(20)14(21-16)10-11-4-2-1-3-5-11/h1-10,19H,(H,17,18,20)/b14-10-
InChIKeyINLYXDRNSVBQOC-UVTDQMKNSA-N
MW296.35 g/mol
LogP3.28
Rot. Bonds2

About (5Z)-5-benzylidene-2-(4-hydroxyphenyl)imino-1,3-thiazolidin-4-one

(5Z)-5-benzylidene-2-(4-hydroxyphenyl)imino-1,3-thiazolidin-4-one (PubChem CID 135437758) has the molecular formula C16H12N2O2S and a molecular weight of 296.35 g/mol. Its IUPAC name is (5Z)-5-benzylidene-2-(4-hydroxyphenyl)imino-1,3-thiazolidin-4-one.

Molecular Properties

Compound Name(5Z)-5-benzylidene-2-(4-hydroxyphenyl)imino-1,3-thiazolidin-4-one
PubChem CID135437758
Molecular FormulaC16H12N2O2S
Molecular Weight296.35 g/mol
Exact Mass296.06
IUPAC Name(5Z)-5-benzylidene-2-(4-hydroxyphenyl)imino-1,3-thiazolidin-4-one
SMILESO=C1N/C(=N\c2ccc(O)cc2)S/C1=C\c1ccccc1
InChIInChI=1S/C16H12N2O2S/c19-13-8-6-12(7-9-13)17-16-18-15(20)14(21-16)10-11-4-2-1-3-5-11/h1-10,19H,(H,17,18,20)/b14-10-
InChIKeyINLYXDRNSVBQOC-UVTDQMKNSA-N
XLogP3.28
TPSA61.69 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.35
LogP ≤ 53.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

Analyze (5Z)-5-benzylidene-2-(4-hydroxyphenyl)imino-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

(2E,5Z)-2-((4-methoxyphenyl)imino)-5-((E)-3-phenylallylidene)thiazolidin-4-one
CID 135418650
2-{(2E)-2-[(4-hydroxyphenyl)imino]-4-oxo-1,3-thiazolidin-5-yl}-N-(4-methylphenyl)acetamide
CID 135439771
5-(4-Methoxy-benzylidene)-2-phenylimino-thiazolidin-4-one
CID 135465730
(5Z)-5-[(4-hydroxyphenyl)methylidene]-3-(2-methylphenyl)-2-propylimino-1,3-thiazolidin-4-one
CID 24957033
5-[(Z)-1-(3,4-dimethoxyphenyl)methylidene]-2-(4-hydroxyanilino)-1,3-thiazol-4-one
CID 135438929
(2E,5Z)-5-(4-(dimethylamino)benzylidene)-2-((4-hydroxyphenyl)imino)thiazolidin-4-one
CID 135498601
2-[(4-hydroxyphenyl)amino]-1,3-thiazol-4(5H)-one
CID 135435921
3-(4-Fluorophenyl)-5-(4-hydroxybenzylidene)-2-imino-1,3-thiazolidin-4-one
CID 1258959
(5Z)-2-(4-hydroxy-N-methylanilino)-5-[(Z)-2-methyl-3-phenylprop-2-enylidene]-1,3-thiazol-4-one
CID 1181853
(Z,Z)-5-(4-Hydroxy-benzylidene)-2-isopropylimino-3-phenyl-thiazolidin-4-one
CID 46236807
(Z,Z)-5-(3-Hydroxy-benzylidene)-2-isopropylimino-3-phenyl-thiazolidin-4-one
CID 46236933
5-(4-Methoxybenzylidene)-2-(phenylimino)-1,3-thiazolidin-4-one
CID 135400261

Frequently Asked Questions

What is the IUPAC name of (5Z)-5-benzylidene-2-(4-hydroxyphenyl)imino-1,3-thiazolidin-4-one?
The IUPAC name of (5Z)-5-benzylidene-2-(4-hydroxyphenyl)imino-1,3-thiazolidin-4-one (CID 135437758) is (5Z)-5-benzylidene-2-(4-hydroxyphenyl)imino-1,3-thiazolidin-4-one.
What is the SMILES notation for (5Z)-5-benzylidene-2-(4-hydroxyphenyl)imino-1,3-thiazolidin-4-one?
The canonical SMILES for (5Z)-5-benzylidene-2-(4-hydroxyphenyl)imino-1,3-thiazolidin-4-one is O=C1N/C(=N\c2ccc(O)cc2)S/C1=C\c1ccccc1.
What is the InChIKey of (5Z)-5-benzylidene-2-(4-hydroxyphenyl)imino-1,3-thiazolidin-4-one?
The InChIKey is INLYXDRNSVBQOC-UVTDQMKNSA-N. The full InChI is InChI=1S/C16H12N2O2S/c19-13-8-6-12(7-9-13)17-16-18-15(20)14(21-16)10-11-4-2-1-3-5-11/h1-10,19H,(H,17,18,20)/b14-10-.
What are the key properties of (5Z)-5-benzylidene-2-(4-hydroxyphenyl)imino-1,3-thiazolidin-4-one?
(5Z)-5-benzylidene-2-(4-hydroxyphenyl)imino-1,3-thiazolidin-4-one has a molecular weight of 296.35 g/mol, XLogP of 3.28, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (5Z)-5-benzylidene-2-(4-hydroxyphenyl)imino-1,3-thiazolidin-4-one is sourced from PubChem (CID 135437758), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).