2-fluoro-4-(2-fluorophenyl)sulfanylpyrimidine

C10H6F2N2S — CID 164645397

IUPAC2-fluoro-4-(2-fluorophenyl)sulfanylpyrimidine
SMILESFc1nccc(Sc2ccccc2F)n1
InChIInChI=1S/C10H6F2N2S/c11-7-3-1-2-4-8(7)15-9-5-6-13-10(12)14-9/h1-6H
InChIKeyGPJQLOXCRGFDLI-UHFFFAOYSA-N
MW224.24 g/mol
LogP2.91
Rot. Bonds2

About 2-fluoro-4-(2-fluorophenyl)sulfanylpyrimidine

2-fluoro-4-(2-fluorophenyl)sulfanylpyrimidine (PubChem CID 164645397) has the molecular formula C10H6F2N2S and a molecular weight of 224.24 g/mol. Its IUPAC name is 2-fluoro-4-(2-fluorophenyl)sulfanylpyrimidine.

Molecular Properties

Compound Name2-fluoro-4-(2-fluorophenyl)sulfanylpyrimidine
PubChem CID164645397
Molecular FormulaC10H6F2N2S
Molecular Weight224.24 g/mol
Exact Mass224.02
IUPAC Name2-fluoro-4-(2-fluorophenyl)sulfanylpyrimidine
SMILESFc1nccc(Sc2ccccc2F)n1
InChIInChI=1S/C10H6F2N2S/c11-7-3-1-2-4-8(7)15-9-5-6-13-10(12)14-9/h1-6H
InChIKeyGPJQLOXCRGFDLI-UHFFFAOYSA-N
XLogP2.91
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.24
LogP ≤ 52.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-fluorophenyl)sulfanylpyrimidine
CID 91491747
2-chloro-6-(2-fluorophenyl)sulfanylpyrazine
CID 43260478
4-chloro-6-(2-fluorophenyl)sulfanylpyrimidin-2-amine
CID 47159001
1-dichlorophosphorylsulfanyl-2-fluorobenzene
CID 21269228
1-fluoro-2-[(2-fluorophenyl)sulfanyl-methylphosphoryl]sulfanylbenzene
CID 175123517
(1R)-1-(2-fluoro-6-pyrimidin-4-ylsulfanylphenyl)ethanol
CID 55239486
4-[(4,5-dimethyl-1,2,4-triazol-3-yl)sulfanyl]-2-fluoropyrimidine
CID 164645400
4-(2-fluorophenyl)sulfanylpyridine-2-carboxylic acid
CID 43143103
2-chloro-4-(2-methylphenyl)sulfanylpyrimidine
CID 62342676
2-chloro-5-fluoro-4-(2-fluorophenyl)sulfanylpyrimidine
CID 79075915
(1R)-1-[2-fluoro-6-(2-fluorophenyl)sulfanylphenyl]ethanol
CID 78951910
4-(2,4-difluorophenyl)sulfanyl-N-methylpyrimidin-2-amine
CID 80892854

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-4-(2-fluorophenyl)sulfanylpyrimidine?
The IUPAC name of 2-fluoro-4-(2-fluorophenyl)sulfanylpyrimidine (CID 164645397) is 2-fluoro-4-(2-fluorophenyl)sulfanylpyrimidine.
What is the SMILES notation for 2-fluoro-4-(2-fluorophenyl)sulfanylpyrimidine?
The canonical SMILES for 2-fluoro-4-(2-fluorophenyl)sulfanylpyrimidine is Fc1nccc(Sc2ccccc2F)n1.
What is the InChIKey of 2-fluoro-4-(2-fluorophenyl)sulfanylpyrimidine?
The InChIKey is GPJQLOXCRGFDLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6F2N2S/c11-7-3-1-2-4-8(7)15-9-5-6-13-10(12)14-9/h1-6H.
What are the key properties of 2-fluoro-4-(2-fluorophenyl)sulfanylpyrimidine?
2-fluoro-4-(2-fluorophenyl)sulfanylpyrimidine has a molecular weight of 224.24 g/mol, XLogP of 2.91, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-4-(2-fluorophenyl)sulfanylpyrimidine is sourced from PubChem (CID 164645397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).