(2Z)-2-[(5-methyl-1,3,4-thiadiazol-2-yl)imino]-3-phenyl-1,3-thiazolidin-4-one

C12H10N4OS2 — CID 14065859

IUPAC(2Z)-2-[(5-methyl-1,3,4-thiadiazol-2-yl)imino]-3-phenyl-1,3-thiazolidin-4-one
SMILESCc1nnc(/N=C2\SCC(=O)N2c2ccccc2)s1
InChIInChI=1S/C12H10N4OS2/c1-8-14-15-11(19-8)13-12-16(10(17)7-18-12)9-5-3-2-4-6-9/h2-6H,7H2,1H3/b13-12-
InChIKeyVNFMBASTVWTTNP-SEYXRHQNSA-N
MW290.37 g/mol
LogP2.61
Rot. Bonds2

About (2Z)-2-[(5-methyl-1,3,4-thiadiazol-2-yl)imino]-3-phenyl-1,3-thiazolidin-4-one

(2Z)-2-[(5-methyl-1,3,4-thiadiazol-2-yl)imino]-3-phenyl-1,3-thiazolidin-4-one (PubChem CID 14065859) has the molecular formula C12H10N4OS2 and a molecular weight of 290.37 g/mol. Its IUPAC name is (2Z)-2-[(5-methyl-1,3,4-thiadiazol-2-yl)imino]-3-phenyl-1,3-thiazolidin-4-one.

Molecular Properties

Compound Name(2Z)-2-[(5-methyl-1,3,4-thiadiazol-2-yl)imino]-3-phenyl-1,3-thiazolidin-4-one
PubChem CID14065859
Molecular FormulaC12H10N4OS2
Molecular Weight290.37 g/mol
Exact Mass290.03
IUPAC Name(2Z)-2-[(5-methyl-1,3,4-thiadiazol-2-yl)imino]-3-phenyl-1,3-thiazolidin-4-one
SMILESCc1nnc(/N=C2\SCC(=O)N2c2ccccc2)s1
InChIInChI=1S/C12H10N4OS2/c1-8-14-15-11(19-8)13-12-16(10(17)7-18-12)9-5-3-2-4-6-9/h2-6H,7H2,1H3/b13-12-
InChIKeyVNFMBASTVWTTNP-SEYXRHQNSA-N
XLogP2.61
TPSA58.45 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.37
LogP ≤ 52.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

Analyze (2Z)-2-[(5-methyl-1,3,4-thiadiazol-2-yl)imino]-3-phenyl-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

CID 3125498
CID 3125498
N-(5-methyl-1,3,4-thiadiazol-2-yl)-2-((4-oxo-3-phenyl-3,4,6,7-tetrahydrothieno[3,2-d]pyrimidin-2-yl)thio)acetamide
CID 2155107
N-Methyl-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-N-phenylacetamide
CID 555687
2-(6-amino-4-oxo-1-phenylpyrimidin-2-yl)sulfanyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide
CID 2171972
(2E,5Z)-5-[(2-fluorophenyl)methylidene]-2-[(5-methyl-1,3,4-thiadiazol-2-yl)imino]-3-phenyl-1,3-thiazolidin-4-one
CID 18846067
(2E,5Z)-5-[(3-fluorophenyl)methylidene]-2-[(5-methyl-1,3,4-thiadiazol-2-yl)imino]-3-phenyl-1,3-thiazolidin-4-one
CID 18846068
(2E,5Z)-5-[(4-fluorophenyl)methylidene]-2-[(5-methyl-1,3,4-thiadiazol-2-yl)imino]-3-phenyl-1,3-thiazolidin-4-one
CID 18846069
(2E,5Z)-5-[1-(4-fluorophenyl)ethylidene]-2-[(5-methyl-1,3,4-thiadiazol-2-yl)imino]-3-phenyl-1,3-thiazolidin-4-one
CID 18846108
N-(4-fluorophenyl)-2-[[5-[(E)-(4-oxo-1,3-thiazolidin-2-ylidene)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]acetamide
CID 136010682
N-(5-methyl-1,3,4-thiadiazol-2-yl)-N-phenylacetamide
CID 1361934
(3S)-3-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-1-phenylpyrrolidine-2,5-dione
CID 777290
(3R)-3-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-1-phenylpyrrolidine-2,5-dione
CID 777291

Frequently Asked Questions

What is the IUPAC name of (2Z)-2-[(5-methyl-1,3,4-thiadiazol-2-yl)imino]-3-phenyl-1,3-thiazolidin-4-one?
The IUPAC name of (2Z)-2-[(5-methyl-1,3,4-thiadiazol-2-yl)imino]-3-phenyl-1,3-thiazolidin-4-one (CID 14065859) is (2Z)-2-[(5-methyl-1,3,4-thiadiazol-2-yl)imino]-3-phenyl-1,3-thiazolidin-4-one.
What is the SMILES notation for (2Z)-2-[(5-methyl-1,3,4-thiadiazol-2-yl)imino]-3-phenyl-1,3-thiazolidin-4-one?
The canonical SMILES for (2Z)-2-[(5-methyl-1,3,4-thiadiazol-2-yl)imino]-3-phenyl-1,3-thiazolidin-4-one is Cc1nnc(/N=C2\SCC(=O)N2c2ccccc2)s1.
What is the InChIKey of (2Z)-2-[(5-methyl-1,3,4-thiadiazol-2-yl)imino]-3-phenyl-1,3-thiazolidin-4-one?
The InChIKey is VNFMBASTVWTTNP-SEYXRHQNSA-N. The full InChI is InChI=1S/C12H10N4OS2/c1-8-14-15-11(19-8)13-12-16(10(17)7-18-12)9-5-3-2-4-6-9/h2-6H,7H2,1H3/b13-12-.
What are the key properties of (2Z)-2-[(5-methyl-1,3,4-thiadiazol-2-yl)imino]-3-phenyl-1,3-thiazolidin-4-one?
(2Z)-2-[(5-methyl-1,3,4-thiadiazol-2-yl)imino]-3-phenyl-1,3-thiazolidin-4-one has a molecular weight of 290.37 g/mol, XLogP of 2.61, 2 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (2Z)-2-[(5-methyl-1,3,4-thiadiazol-2-yl)imino]-3-phenyl-1,3-thiazolidin-4-one is sourced from PubChem (CID 14065859), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).