(5Z)-5-[(4-hydroxyphenyl)methylidene]-2-[(4-methoxyphenyl)methylimino]-1,3-thiazolidin-4-one

C18H16N2O3S — CID 177376646

IUPAC(5Z)-5-[(4-hydroxyphenyl)methylidene]-2-[(4-methoxyphenyl)methylimino]-1,3-thiazolidin-4-one
SMILESCOc1ccc(C/N=C2\NC(=O)/C(=C/c3ccc(O)cc3)S2)cc1
InChIInChI=1S/C18H16N2O3S/c1-23-15-8-4-13(5-9-15)11-19-18-20-17(22)16(24-18)10-12-2-6-14(21)7-3-12/h2-10,21H,11H2,1H3,(H,19,20,22)/b16-10-
InChIKeySXZKCPYYAQHJHH-YBEGLDIGSA-N
MW340.40 g/mol
LogP3.16
Rot. Bonds4

About (5Z)-5-[(4-hydroxyphenyl)methylidene]-2-[(4-methoxyphenyl)methylimino]-1,3-thiazolidin-4-one

(5Z)-5-[(4-hydroxyphenyl)methylidene]-2-[(4-methoxyphenyl)methylimino]-1,3-thiazolidin-4-one (PubChem CID 177376646) has the molecular formula C18H16N2O3S and a molecular weight of 340.40 g/mol. Its IUPAC name is (5Z)-5-[(4-hydroxyphenyl)methylidene]-2-[(4-methoxyphenyl)methylimino]-1,3-thiazolidin-4-one.

Molecular Properties

Compound Name(5Z)-5-[(4-hydroxyphenyl)methylidene]-2-[(4-methoxyphenyl)methylimino]-1,3-thiazolidin-4-one
PubChem CID177376646
Molecular FormulaC18H16N2O3S
Molecular Weight340.40 g/mol
Exact Mass340.09
IUPAC Name(5Z)-5-[(4-hydroxyphenyl)methylidene]-2-[(4-methoxyphenyl)methylimino]-1,3-thiazolidin-4-one
SMILESCOc1ccc(C/N=C2\NC(=O)/C(=C/c3ccc(O)cc3)S2)cc1
InChIInChI=1S/C18H16N2O3S/c1-23-15-8-4-13(5-9-15)11-19-18-20-17(22)16(24-18)10-12-2-6-14(21)7-3-12/h2-10,21H,11H2,1H3,(H,19,20,22)/b16-10-
InChIKeySXZKCPYYAQHJHH-YBEGLDIGSA-N
XLogP3.16
TPSA70.92 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.40
LogP ≤ 53.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze (5Z)-5-[(4-hydroxyphenyl)methylidene]-2-[(4-methoxyphenyl)methylimino]-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

5-(4-Methoxy-benzylidene)-2-phenylimino-thiazolidin-4-one
CID 135465730
5-(4-Methoxybenzylidene)-2-(phenylimino)-1,3-thiazolidin-4-one
CID 135400261
2-Hydroxybenzaldehyde [5-(4-methoxybenzylidene)-4-oxo-1,3-thiazolidin-2-ylidene]hydrazone
CID 135472610
(5E)-2-(benzylamino)-5-[(4-hydroxyphenyl)methylidene]-1,3-thiazol-4-one
CID 135486338
(5Z)-2-benzylimino-5-[(4-hydroxyphenyl)methylidene]-1,3-thiazolidin-4-one
CID 135574941
(5Z)-2-benzylimino-5-[(3,4-dimethoxyphenyl)methylidene]-1,3-thiazolidin-4-one
CID 137283359
(5Z)-2-benzylimino-5-[(3-ethoxy-4-hydroxyphenyl)methylidene]-1,3-thiazolidin-4-one
CID 137287458
(5Z)-2-(benzylamino)-5-[(4-methoxyphenyl)methylidene]-1,3-thiazol-4-one
CID 135461910
(5E)-5-[(4-methoxyphenyl)methylidene]-2-(2-methylphenyl)imino-1,3-thiazolidin-4-one
CID 135620564
5-[(4-Methoxyphenyl)methylene]-2-[(4-methylphenyl)azamethylene]-1,3-thiazolidi n-4-one
CID 135799334
(5Z)-5-[(4-hydroxyphenyl)methylidene]-2-[7-[[(5Z)-5-[(4-hydroxyphenyl)methylidene]-4-oxo-1,3-thiazolidin-2-ylidene]amino]heptylimino]-1,3-thiazolidin-4-one
CID 136216676
(5Z)-5-[(4-hydroxyphenyl)methylidene]-2-[8-[[(5Z)-5-[(4-hydroxyphenyl)methylidene]-4-oxo-1,3-thiazolidin-2-ylidene]amino]octylimino]-1,3-thiazolidin-4-one
CID 136216685

Frequently Asked Questions

What is the IUPAC name of (5Z)-5-[(4-hydroxyphenyl)methylidene]-2-[(4-methoxyphenyl)methylimino]-1,3-thiazolidin-4-one?
The IUPAC name of (5Z)-5-[(4-hydroxyphenyl)methylidene]-2-[(4-methoxyphenyl)methylimino]-1,3-thiazolidin-4-one (CID 177376646) is (5Z)-5-[(4-hydroxyphenyl)methylidene]-2-[(4-methoxyphenyl)methylimino]-1,3-thiazolidin-4-one.
What is the SMILES notation for (5Z)-5-[(4-hydroxyphenyl)methylidene]-2-[(4-methoxyphenyl)methylimino]-1,3-thiazolidin-4-one?
The canonical SMILES for (5Z)-5-[(4-hydroxyphenyl)methylidene]-2-[(4-methoxyphenyl)methylimino]-1,3-thiazolidin-4-one is COc1ccc(C/N=C2\NC(=O)/C(=C/c3ccc(O)cc3)S2)cc1.
What is the InChIKey of (5Z)-5-[(4-hydroxyphenyl)methylidene]-2-[(4-methoxyphenyl)methylimino]-1,3-thiazolidin-4-one?
The InChIKey is SXZKCPYYAQHJHH-YBEGLDIGSA-N. The full InChI is InChI=1S/C18H16N2O3S/c1-23-15-8-4-13(5-9-15)11-19-18-20-17(22)16(24-18)10-12-2-6-14(21)7-3-12/h2-10,21H,11H2,1H3,(H,19,20,22)/b16-10-.
What are the key properties of (5Z)-5-[(4-hydroxyphenyl)methylidene]-2-[(4-methoxyphenyl)methylimino]-1,3-thiazolidin-4-one?
(5Z)-5-[(4-hydroxyphenyl)methylidene]-2-[(4-methoxyphenyl)methylimino]-1,3-thiazolidin-4-one has a molecular weight of 340.40 g/mol, XLogP of 3.16, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (5Z)-5-[(4-hydroxyphenyl)methylidene]-2-[(4-methoxyphenyl)methylimino]-1,3-thiazolidin-4-one is sourced from PubChem (CID 177376646), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).