2-(furan-2-yl)-3-[4-pyridin-2-yl-6-(1-pyrimidin-2-ylimidazol-4-yl)pyrimidin-2-yl]-1,3-thiazolidin-4-one

C23H16N8O2S — CID 155293070

IUPAC2-(furan-2-yl)-3-[4-pyridin-2-yl-6-(1-pyrimidin-2-ylimidazol-4-yl)pyrimidin-2-yl]-1,3-thiazolidin-4-one
SMILESO=C1CSC(c2ccco2)N1c1nc(-c2ccccn2)cc(-c2cn(-c3ncccn3)cn2)n1
InChIInChI=1S/C23H16N8O2S/c32-20-13-34-21(19-6-3-10-33-19)31(20)23-28-16(15-5-1-2-7-24-15)11-17(29-23)18-12-30(14-27-18)22-25-8-4-9-26-22/h1-12,14,21H,13H2
InChIKeyCJIDUWZYFHCZCZ-UHFFFAOYSA-N
MW468.50 g/mol
LogP3.55
Rot. Bonds5

About 2-(furan-2-yl)-3-[4-pyridin-2-yl-6-(1-pyrimidin-2-ylimidazol-4-yl)pyrimidin-2-yl]-1,3-thiazolidin-4-one

2-(furan-2-yl)-3-[4-pyridin-2-yl-6-(1-pyrimidin-2-ylimidazol-4-yl)pyrimidin-2-yl]-1,3-thiazolidin-4-one (PubChem CID 155293070) has the molecular formula C23H16N8O2S and a molecular weight of 468.50 g/mol. Its IUPAC name is 2-(furan-2-yl)-3-[4-pyridin-2-yl-6-(1-pyrimidin-2-ylimidazol-4-yl)pyrimidin-2-yl]-1,3-thiazolidin-4-one.

Molecular Properties

Compound Name2-(furan-2-yl)-3-[4-pyridin-2-yl-6-(1-pyrimidin-2-ylimidazol-4-yl)pyrimidin-2-yl]-1,3-thiazolidin-4-one
PubChem CID155293070
Molecular FormulaC23H16N8O2S
Molecular Weight468.50 g/mol
Exact Mass468.11
IUPAC Name2-(furan-2-yl)-3-[4-pyridin-2-yl-6-(1-pyrimidin-2-ylimidazol-4-yl)pyrimidin-2-yl]-1,3-thiazolidin-4-one
SMILESO=C1CSC(c2ccco2)N1c1nc(-c2ccccn2)cc(-c2cn(-c3ncccn3)cn2)n1
InChIInChI=1S/C23H16N8O2S/c32-20-13-34-21(19-6-3-10-33-19)31(20)23-28-16(15-5-1-2-7-24-15)11-17(29-23)18-12-30(14-27-18)22-25-8-4-9-26-22/h1-12,14,21H,13H2
InChIKeyCJIDUWZYFHCZCZ-UHFFFAOYSA-N
XLogP3.55
TPSA115.72 Ų
H-Bond Donors
H-Bond Acceptors10
Rotatable Bonds5
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500468.50
LogP ≤ 53.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1010

Analyze 2-(furan-2-yl)-3-[4-pyridin-2-yl-6-(1-pyrimidin-2-ylimidazol-4-yl)pyrimidin-2-yl]-1,3-thiazolidin-4-one with MolForge

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Related Compounds

4-(2-Furyl)-2-({3-oxo-3-[4-(2-pyridinyl)-1-piperazinyl]propyl}thio)-6-(trifluoromethyl)pyrimidine
CID 2964177
8-[4-(furan-2-carbonyl)piperazin-1-yl]-1,3-dimethyl-7-[2-(pyrimidin-2-ylsulfanyl)ethyl]-2,3,6,7-tetrahydro-1H-purine-2,6-dione
CID 16187101
8-(4-(furan-2-carbonyl)piperazin-1-yl)-3-methyl-7-(3-(pyrimidin-2-ylthio)propyl)-1H-purine-2,6(3H,7H)-dione
CID 16194988
2-(2-{[(3-Fluorophenyl)methyl]sulfanyl}-3H-imidazo[4,5-C]pyridin-3-YL)-N-[(furan-2-YL)methyl]acetamide
CID 20890602
[2-[[furan-2-ylmethyl(methyl)amino]methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-(1-methylpyrrol-2-yl)methanone
CID 97382184
4-{[2-(Benzylsulfanyl)-3H-imidazo[4,5-C]pyridin-3-YL]methyl}-N-[(furan-2-YL)methyl]benzamide
CID 6624703
N-(furan-2-ylmethyl)-3-phenyl-N-(thiophen-2-ylmethyl)imidazole-4-carboxamide
CID 16260649
4-[({3-Benzyl-3H-imidazo[4,5-C]pyridin-2-YL}sulfanyl)methyl]-N-[(furan-2-YL)methyl]benzamide
CID 20891124
N-(furan-2-ylmethyl)-1-phenyl-5-((pyrimidin-2-ylthio)methyl)-1H-1,2,3-triazole-4-carboxamide
CID 30836871
1-{3-[2-(Furan-2-YL)-3H-imidazo[4,5-B]pyridin-3-YL]pyrrolidin-1-YL}-2-(thiophen-2-YL)ethan-1-one
CID 53186868
[3-[2-(Furan-2-yl)imidazo[4,5-b]pyridin-3-yl]pyrrolidin-1-yl]-thiophen-2-ylmethanone
CID 53186874
2-{1-[1-(2-furoyl)piperidin-4-yl]-1H-imidazol-2-yl}pyridine
CID 56714544

Frequently Asked Questions

What is the IUPAC name of 2-(furan-2-yl)-3-[4-pyridin-2-yl-6-(1-pyrimidin-2-ylimidazol-4-yl)pyrimidin-2-yl]-1,3-thiazolidin-4-one?
The IUPAC name of 2-(furan-2-yl)-3-[4-pyridin-2-yl-6-(1-pyrimidin-2-ylimidazol-4-yl)pyrimidin-2-yl]-1,3-thiazolidin-4-one (CID 155293070) is 2-(furan-2-yl)-3-[4-pyridin-2-yl-6-(1-pyrimidin-2-ylimidazol-4-yl)pyrimidin-2-yl]-1,3-thiazolidin-4-one.
What is the SMILES notation for 2-(furan-2-yl)-3-[4-pyridin-2-yl-6-(1-pyrimidin-2-ylimidazol-4-yl)pyrimidin-2-yl]-1,3-thiazolidin-4-one?
The canonical SMILES for 2-(furan-2-yl)-3-[4-pyridin-2-yl-6-(1-pyrimidin-2-ylimidazol-4-yl)pyrimidin-2-yl]-1,3-thiazolidin-4-one is O=C1CSC(c2ccco2)N1c1nc(-c2ccccn2)cc(-c2cn(-c3ncccn3)cn2)n1.
What is the InChIKey of 2-(furan-2-yl)-3-[4-pyridin-2-yl-6-(1-pyrimidin-2-ylimidazol-4-yl)pyrimidin-2-yl]-1,3-thiazolidin-4-one?
The InChIKey is CJIDUWZYFHCZCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H16N8O2S/c32-20-13-34-21(19-6-3-10-33-19)31(20)23-28-16(15-5-1-2-7-24-15)11-17(29-23)18-12-30(14-27-18)22-25-8-4-9-26-22/h1-12,14,21H,13H2.
What are the key properties of 2-(furan-2-yl)-3-[4-pyridin-2-yl-6-(1-pyrimidin-2-ylimidazol-4-yl)pyrimidin-2-yl]-1,3-thiazolidin-4-one?
2-(furan-2-yl)-3-[4-pyridin-2-yl-6-(1-pyrimidin-2-ylimidazol-4-yl)pyrimidin-2-yl]-1,3-thiazolidin-4-one has a molecular weight of 468.50 g/mol, XLogP of 3.55, 5 rotatable bonds, 0 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(furan-2-yl)-3-[4-pyridin-2-yl-6-(1-pyrimidin-2-ylimidazol-4-yl)pyrimidin-2-yl]-1,3-thiazolidin-4-one is sourced from PubChem (CID 155293070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).