5-(furan-2-yl)-6-pyrazin-2-yl-1-pyridin-2-yl-3-pyrimidin-2-yl-4-thiophen-2-ylpyridin-2-one

C26H16N6O2S — CID 141228406

IUPAC5-(furan-2-yl)-6-pyrazin-2-yl-1-pyridin-2-yl-3-pyrimidin-2-yl-4-thiophen-2-ylpyridin-2-one
SMILESO=c1c(-c2ncccn2)c(-c2cccs2)c(-c2ccco2)c(-c2cnccn2)n1-c1ccccn1
InChIInChI=1S/C26H16N6O2S/c33-26-23(25-30-10-5-11-31-25)22(19-7-4-15-35-19)21(18-6-3-14-34-18)24(17-16-27-12-13-28-17)32(26)20-8-1-2-9-29-20/h1-16H
InChIKeyQCAILLOGLGPQHY-UHFFFAOYSA-N
MW476.52 g/mol
LogP5.14
Rot. Bonds5

About 5-(furan-2-yl)-6-pyrazin-2-yl-1-pyridin-2-yl-3-pyrimidin-2-yl-4-thiophen-2-ylpyridin-2-one

5-(furan-2-yl)-6-pyrazin-2-yl-1-pyridin-2-yl-3-pyrimidin-2-yl-4-thiophen-2-ylpyridin-2-one (PubChem CID 141228406) has the molecular formula C26H16N6O2S and a molecular weight of 476.52 g/mol. Its IUPAC name is 5-(furan-2-yl)-6-pyrazin-2-yl-1-pyridin-2-yl-3-pyrimidin-2-yl-4-thiophen-2-ylpyridin-2-one.

Molecular Properties

Compound Name5-(furan-2-yl)-6-pyrazin-2-yl-1-pyridin-2-yl-3-pyrimidin-2-yl-4-thiophen-2-ylpyridin-2-one
PubChem CID141228406
Molecular FormulaC26H16N6O2S
Molecular Weight476.52 g/mol
Exact Mass476.11
IUPAC Name5-(furan-2-yl)-6-pyrazin-2-yl-1-pyridin-2-yl-3-pyrimidin-2-yl-4-thiophen-2-ylpyridin-2-one
SMILESO=c1c(-c2ncccn2)c(-c2cccs2)c(-c2ccco2)c(-c2cnccn2)n1-c1ccccn1
InChIInChI=1S/C26H16N6O2S/c33-26-23(25-30-10-5-11-31-25)22(19-7-4-15-35-19)21(18-6-3-14-34-18)24(17-16-27-12-13-28-17)32(26)20-8-1-2-9-29-20/h1-16H
InChIKeyQCAILLOGLGPQHY-UHFFFAOYSA-N
XLogP5.14
TPSA99.59 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds5
Heavy Atoms35
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500476.52
LogP ≤ 55.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

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Launch Full Analysis

Related Compounds

8-(2-Fluoro-4-pyridinyl)-2-(furan-2-ylmethyl)-6-thiophen-2-ylimidazo[1,2-a]pyrazine
CID 134211554
2-(Furan-2-yl)-3-{4-(pyridin-2-yl)-6-[1-(pyrimidin-2-yl)-1 H-imidazol-4-yl]pyrimidin-2-yl}-1,3-thiazolidin-4-one
CID 155293070
N-(2-furylmethyl)-2-pyridin-3-yl-N-(2-thienylmethyl)pyrimidine-5-carboxamide
CID 50962027
4-(2-Furylmethylsulfanylmethyl)-6-morpholin-4-yl-2-pyridin-2-yl-pyrimidine
CID 58137203
(3R)-3-[5-[5-(furan-3-yl)thiophen-2-yl]imidazol-1-yl]-1-azabicyclo[2.2.2]octane
CID 59774856
3-[5-[5-(Furan-3-yl)thiophen-2-yl]imidazol-1-yl]-1-azabicyclo[2.2.2]octane
CID 69272535
N-[2-(furan-2-yl)-6-thiophen-2-ylpyrimidin-4-yl]-2-pyridin-3-ylacetamide
CID 69645288
8-Ethyl-6-[5-(furan-3-yl)thiophen-2-yl]-2-[4-(4-methylpiperazin-1-yl)anilino]pyrido[2,3-d]pyrimidin-7-one
CID 89631978
5-(furan-2-yl)-3-pyridazin-3-yl-1-pyridin-2-yl-2-pyrimidin-2-yl-6-thiophen-2-yl-2H-pyrazine
CID 141035121
3-(furan-2-yl)-4-pyrazin-2-yl-2-pyridin-2-yl-5-thiophen-2-yl-3H-1,2-oxazole
CID 141061125
2-[2-(Furan-2-yl)-4-pyridin-2-ylthiophen-3-yl]pyrimidine
CID 141073692
5-(Furan-2-yl)-2-pyridin-2-yl-4-thiophen-2-ylpyrimidine
CID 141091633

Frequently Asked Questions

What is the IUPAC name of 5-(furan-2-yl)-6-pyrazin-2-yl-1-pyridin-2-yl-3-pyrimidin-2-yl-4-thiophen-2-ylpyridin-2-one?
The IUPAC name of 5-(furan-2-yl)-6-pyrazin-2-yl-1-pyridin-2-yl-3-pyrimidin-2-yl-4-thiophen-2-ylpyridin-2-one (CID 141228406) is 5-(furan-2-yl)-6-pyrazin-2-yl-1-pyridin-2-yl-3-pyrimidin-2-yl-4-thiophen-2-ylpyridin-2-one.
What is the SMILES notation for 5-(furan-2-yl)-6-pyrazin-2-yl-1-pyridin-2-yl-3-pyrimidin-2-yl-4-thiophen-2-ylpyridin-2-one?
The canonical SMILES for 5-(furan-2-yl)-6-pyrazin-2-yl-1-pyridin-2-yl-3-pyrimidin-2-yl-4-thiophen-2-ylpyridin-2-one is O=c1c(-c2ncccn2)c(-c2cccs2)c(-c2ccco2)c(-c2cnccn2)n1-c1ccccn1.
What is the InChIKey of 5-(furan-2-yl)-6-pyrazin-2-yl-1-pyridin-2-yl-3-pyrimidin-2-yl-4-thiophen-2-ylpyridin-2-one?
The InChIKey is QCAILLOGLGPQHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H16N6O2S/c33-26-23(25-30-10-5-11-31-25)22(19-7-4-15-35-19)21(18-6-3-14-34-18)24(17-16-27-12-13-28-17)32(26)20-8-1-2-9-29-20/h1-16H.
What are the key properties of 5-(furan-2-yl)-6-pyrazin-2-yl-1-pyridin-2-yl-3-pyrimidin-2-yl-4-thiophen-2-ylpyridin-2-one?
5-(furan-2-yl)-6-pyrazin-2-yl-1-pyridin-2-yl-3-pyrimidin-2-yl-4-thiophen-2-ylpyridin-2-one has a molecular weight of 476.52 g/mol, XLogP of 5.14, 5 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(furan-2-yl)-6-pyrazin-2-yl-1-pyridin-2-yl-3-pyrimidin-2-yl-4-thiophen-2-ylpyridin-2-one is sourced from PubChem (CID 141228406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).