4-fluoro-6-thiophen-2-ylsulfanylpyrimidine

C8H5FN2S2 — CID 115417285

IUPAC4-fluoro-6-thiophen-2-ylsulfanylpyrimidine
SMILESFc1cc(Sc2cccs2)ncn1
InChIInChI=1S/C8H5FN2S2/c9-6-4-7(11-5-10-6)13-8-2-1-3-12-8/h1-5H
InChIKeyFKAUGYRKURVRIQ-UHFFFAOYSA-N
MW212.27 g/mol
LogP2.83
Rot. Bonds2

About 4-fluoro-6-thiophen-2-ylsulfanylpyrimidine

4-fluoro-6-thiophen-2-ylsulfanylpyrimidine (PubChem CID 115417285) has the molecular formula C8H5FN2S2 and a molecular weight of 212.27 g/mol. Its IUPAC name is 4-fluoro-6-thiophen-2-ylsulfanylpyrimidine.

Molecular Properties

Compound Name4-fluoro-6-thiophen-2-ylsulfanylpyrimidine
PubChem CID115417285
Molecular FormulaC8H5FN2S2
Molecular Weight212.27 g/mol
Exact Mass211.99
IUPAC Name4-fluoro-6-thiophen-2-ylsulfanylpyrimidine
SMILESFc1cc(Sc2cccs2)ncn1
InChIInChI=1S/C8H5FN2S2/c9-6-4-7(11-5-10-6)13-8-2-1-3-12-8/h1-5H
InChIKeyFKAUGYRKURVRIQ-UHFFFAOYSA-N
XLogP2.83
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.27
LogP ≤ 52.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

4-chloro-6-thiophen-2-ylsulfanylpyrimidine
CID 61279172
4-fluoro-6-methylsulfanylpyrimidine
CID 115417338
2-(6-fluoropyrimidin-4-yl)sulfanylpyrimidine-4,6-diamine
CID 115417341
4-fluoro-6-(2-methoxyphenyl)sulfanylpyrimidine
CID 115417343
5-thiophen-2-ylsulfanyl-1H-1,2,4-triazole
CID 141130779
2-chloro-6-thiophen-2-ylsulfanyl-4-(trifluoromethyl)pyridine
CID 102716286
4-fluoro-6-(2-nitrophenyl)sulfanylpyrimidine
CID 115417324
6-phenyl-4-thiophen-2-ylsulfanyl-7H-pyrrolo[2,3-d]pyrimidine
CID 141052128
4-fluoro-6-(4-methylsulfonylphenyl)sulfanylpyrimidine
CID 113305742
N-methyl-5-propan-2-yl-6-thiophen-2-ylsulfanylpyrimidin-4-amine
CID 80888546
2,3,5-trichloro-6-thiophen-2-ylsulfanylpyridine
CID 102752219
N,2-dimethyl-6-thiophen-2-ylsulfanylpyrimidin-4-amine
CID 80886717

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-6-thiophen-2-ylsulfanylpyrimidine?
The IUPAC name of 4-fluoro-6-thiophen-2-ylsulfanylpyrimidine (CID 115417285) is 4-fluoro-6-thiophen-2-ylsulfanylpyrimidine.
What is the SMILES notation for 4-fluoro-6-thiophen-2-ylsulfanylpyrimidine?
The canonical SMILES for 4-fluoro-6-thiophen-2-ylsulfanylpyrimidine is Fc1cc(Sc2cccs2)ncn1.
What is the InChIKey of 4-fluoro-6-thiophen-2-ylsulfanylpyrimidine?
The InChIKey is FKAUGYRKURVRIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H5FN2S2/c9-6-4-7(11-5-10-6)13-8-2-1-3-12-8/h1-5H.
What are the key properties of 4-fluoro-6-thiophen-2-ylsulfanylpyrimidine?
4-fluoro-6-thiophen-2-ylsulfanylpyrimidine has a molecular weight of 212.27 g/mol, XLogP of 2.83, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-6-thiophen-2-ylsulfanylpyrimidine is sourced from PubChem (CID 115417285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).