5-bromo-4-(3,4-dichlorophenyl)sulfanylpyridin-3-amine

C11H7BrCl2N2S — CID 103519211

IUPAC5-bromo-4-(3,4-dichlorophenyl)sulfanylpyridin-3-amine
SMILESNc1cncc(Br)c1Sc1ccc(Cl)c(Cl)c1
InChIInChI=1S/C11H7BrCl2N2S/c12-7-4-16-5-10(15)11(7)17-6-1-2-8(13)9(14)3-6/h1-5H,15H2
InChIKeyABGXXOASEZDZOF-UHFFFAOYSA-N
MW350.07 g/mol
LogP4.88
Rot. Bonds2

About 5-bromo-4-(3,4-dichlorophenyl)sulfanylpyridin-3-amine

5-bromo-4-(3,4-dichlorophenyl)sulfanylpyridin-3-amine (PubChem CID 103519211) has the molecular formula C11H7BrCl2N2S and a molecular weight of 350.07 g/mol. Its IUPAC name is 5-bromo-4-(3,4-dichlorophenyl)sulfanylpyridin-3-amine.

Molecular Properties

Compound Name5-bromo-4-(3,4-dichlorophenyl)sulfanylpyridin-3-amine
PubChem CID103519211
Molecular FormulaC11H7BrCl2N2S
Molecular Weight350.07 g/mol
Exact Mass347.89
IUPAC Name5-bromo-4-(3,4-dichlorophenyl)sulfanylpyridin-3-amine
SMILESNc1cncc(Br)c1Sc1ccc(Cl)c(Cl)c1
InChIInChI=1S/C11H7BrCl2N2S/c12-7-4-16-5-10(15)11(7)17-6-1-2-8(13)9(14)3-6/h1-5H,15H2
InChIKeyABGXXOASEZDZOF-UHFFFAOYSA-N
XLogP4.88
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.07
LogP ≤ 54.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 5-bromo-4-(3,4-dichlorophenyl)sulfanylpyridin-3-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

5-bromo-4-(4-bromophenyl)sulfanylpyridin-3-amine
CID 103519159
5-bromo-4-(4-methylphenyl)sulfanylpyridin-3-amine
CID 103519123
5-bromo-4-pyridin-2-ylsulfanylpyridin-3-amine
CID 103519134
2-chloro-4-(3,4-dichlorophenyl)sulfanylpyrimidin-5-amine
CID 114044360
5-bromo-4-(1,3-thiazol-2-ylsulfanyl)pyridin-3-amine
CID 103519175
2-[(3-amino-5-bromo-4-pyridinyl)sulfanyl]-1H-pyrimidin-6-one
CID 103519154
5-bromo-4-[[5-(trifluoromethyl)-2-pyridinyl]sulfanyl]pyridin-3-amine
CID 103519131
[5-bromo-4-(3,4-dichlorophenyl)sulfanylpyrimidin-2-yl]hydrazine
CID 80929377
methyl 3-amino-2-(3,4-dichlorophenyl)sulfanylbenzoate
CID 115935997
2-bromo-5-(4-chlorophenyl)sulfanylaniline
CID 91876650
6-(3,4-dichlorophenyl)sulfanylisoquinolin-5-amine
CID 106948836
5-bromo-4-(3,4-dichlorophenyl)sulfanyl-N-methylpyrimidin-2-amine
CID 80891409

Frequently Asked Questions

What is the IUPAC name of 5-bromo-4-(3,4-dichlorophenyl)sulfanylpyridin-3-amine?
The IUPAC name of 5-bromo-4-(3,4-dichlorophenyl)sulfanylpyridin-3-amine (CID 103519211) is 5-bromo-4-(3,4-dichlorophenyl)sulfanylpyridin-3-amine.
What is the SMILES notation for 5-bromo-4-(3,4-dichlorophenyl)sulfanylpyridin-3-amine?
The canonical SMILES for 5-bromo-4-(3,4-dichlorophenyl)sulfanylpyridin-3-amine is Nc1cncc(Br)c1Sc1ccc(Cl)c(Cl)c1.
What is the InChIKey of 5-bromo-4-(3,4-dichlorophenyl)sulfanylpyridin-3-amine?
The InChIKey is ABGXXOASEZDZOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7BrCl2N2S/c12-7-4-16-5-10(15)11(7)17-6-1-2-8(13)9(14)3-6/h1-5H,15H2.
What are the key properties of 5-bromo-4-(3,4-dichlorophenyl)sulfanylpyridin-3-amine?
5-bromo-4-(3,4-dichlorophenyl)sulfanylpyridin-3-amine has a molecular weight of 350.07 g/mol, XLogP of 4.88, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-4-(3,4-dichlorophenyl)sulfanylpyridin-3-amine is sourced from PubChem (CID 103519211), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).