6-bromo-2-(2-fluorophenyl)sulfanylpyrimidin-4-amine

C10H7BrFN3S — CID 116798140

IUPAC6-bromo-2-(2-fluorophenyl)sulfanylpyrimidin-4-amine
SMILESNc1cc(Br)nc(Sc2ccccc2F)n1
InChIInChI=1S/C10H7BrFN3S/c11-8-5-9(13)15-10(14-8)16-7-4-2-1-3-6(7)12/h1-5H,(H2,13,14,15)
InChIKeyRNHOMBYDSFFPDC-UHFFFAOYSA-N
MW300.16 g/mol
LogP3.11
Rot. Bonds2

About 6-bromo-2-(2-fluorophenyl)sulfanylpyrimidin-4-amine

6-bromo-2-(2-fluorophenyl)sulfanylpyrimidin-4-amine (PubChem CID 116798140) has the molecular formula C10H7BrFN3S and a molecular weight of 300.16 g/mol. Its IUPAC name is 6-bromo-2-(2-fluorophenyl)sulfanylpyrimidin-4-amine.

Molecular Properties

Compound Name6-bromo-2-(2-fluorophenyl)sulfanylpyrimidin-4-amine
PubChem CID116798140
Molecular FormulaC10H7BrFN3S
Molecular Weight300.16 g/mol
Exact Mass298.95
IUPAC Name6-bromo-2-(2-fluorophenyl)sulfanylpyrimidin-4-amine
SMILESNc1cc(Br)nc(Sc2ccccc2F)n1
InChIInChI=1S/C10H7BrFN3S/c11-8-5-9(13)15-10(14-8)16-7-4-2-1-3-6(7)12/h1-5H,(H2,13,14,15)
InChIKeyRNHOMBYDSFFPDC-UHFFFAOYSA-N
XLogP3.11
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.16
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 6-bromo-2-(2-fluorophenyl)sulfanylpyrimidin-4-amine 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

[2-(2-fluorophenyl)sulfanyl-6-methylpyrimidin-4-yl]methanamine
CID 107552247
2-(3-fluoro-2-nitrophenyl)sulfanylpyrimidine-4,6-diamine
CID 62688960
2-(2-fluorophenyl)sulfanylpyrimidine
CID 91491747
4-(2-fluorophenyl)sulfanyl-6-pyrazol-1-yl-1,3,5-triazin-2-amine
CID 80885105
6-bromo-4-fluoropyridin-2-amine
CID 130713421
6-(2-fluorophenyl)sulfanyl-2-(methoxymethyl)pyrimidin-4-amine
CID 113401710
4-chloro-6-(2-fluorophenyl)sulfanylpyrimidin-2-amine
CID 47159001
4-(2-fluorophenyl)sulfanyl-6-hydrazinyl-N,N-dimethyl-1,3,5-triazin-2-amine
CID 80921868
6-bromo-2-(2-fluoro-6-nitrophenoxy)pyrimidin-4-amine
CID 116798026
2-(2,5-difluorophenyl)sulfanylpyrimidin-4-amine
CID 116798209
6-bromo-4-(2-fluorophenyl)sulfanylquinolin-3-amine
CID 43621479
[4-bromo-2-(2-fluorophenyl)sulfanylphenyl]methanol
CID 55237943

Frequently Asked Questions

What is the IUPAC name of 6-bromo-2-(2-fluorophenyl)sulfanylpyrimidin-4-amine?
The IUPAC name of 6-bromo-2-(2-fluorophenyl)sulfanylpyrimidin-4-amine (CID 116798140) is 6-bromo-2-(2-fluorophenyl)sulfanylpyrimidin-4-amine.
What is the SMILES notation for 6-bromo-2-(2-fluorophenyl)sulfanylpyrimidin-4-amine?
The canonical SMILES for 6-bromo-2-(2-fluorophenyl)sulfanylpyrimidin-4-amine is Nc1cc(Br)nc(Sc2ccccc2F)n1.
What is the InChIKey of 6-bromo-2-(2-fluorophenyl)sulfanylpyrimidin-4-amine?
The InChIKey is RNHOMBYDSFFPDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7BrFN3S/c11-8-5-9(13)15-10(14-8)16-7-4-2-1-3-6(7)12/h1-5H,(H2,13,14,15).
What are the key properties of 6-bromo-2-(2-fluorophenyl)sulfanylpyrimidin-4-amine?
6-bromo-2-(2-fluorophenyl)sulfanylpyrimidin-4-amine has a molecular weight of 300.16 g/mol, XLogP of 3.11, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-2-(2-fluorophenyl)sulfanylpyrimidin-4-amine is sourced from PubChem (CID 116798140), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).