4-amino-3-bromo-6-(difluoromethyl)pyridine-2-sulfonyl chloride

C6H4BrClF2N2O2S — CID 118817000

IUPAC4-amino-3-bromo-6-(difluoromethyl)pyridine-2-sulfonyl chloride
SMILESNc1cc(C(F)F)nc(S(=O)(=O)Cl)c1Br
InChIInChI=1S/C6H4BrClF2N2O2S/c7-4-2(11)1-3(5(9)10)12-6(4)15(8,13)14/h1,5H,(H2,11,12)
InChIKeyYUDWDHYRICCFNJ-UHFFFAOYSA-N
MW321.53 g/mol
LogP2.29
Rot. Bonds2

About 4-amino-3-bromo-6-(difluoromethyl)pyridine-2-sulfonyl chloride

4-amino-3-bromo-6-(difluoromethyl)pyridine-2-sulfonyl chloride (PubChem CID 118817000) has the molecular formula C6H4BrClF2N2O2S and a molecular weight of 321.53 g/mol. Its IUPAC name is 4-amino-3-bromo-6-(difluoromethyl)pyridine-2-sulfonyl chloride.

Molecular Properties

Compound Name4-amino-3-bromo-6-(difluoromethyl)pyridine-2-sulfonyl chloride
PubChem CID118817000
Molecular FormulaC6H4BrClF2N2O2S
Molecular Weight321.53 g/mol
Exact Mass319.88
IUPAC Name4-amino-3-bromo-6-(difluoromethyl)pyridine-2-sulfonyl chloride
SMILESNc1cc(C(F)F)nc(S(=O)(=O)Cl)c1Br
InChIInChI=1S/C6H4BrClF2N2O2S/c7-4-2(11)1-3(5(9)10)12-6(4)15(8,13)14/h1,5H,(H2,11,12)
InChIKeyYUDWDHYRICCFNJ-UHFFFAOYSA-N
XLogP2.29
TPSA73.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.53
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-amino-3-bromo-6-(difluoromethyl)pyridine-2-sulfonamide
CID 118839782
4-amino-2-bromo-6-(difluoromethyl)pyridine-3-sulfonyl chloride
CID 118840544
3-bromo-6-(difluoromethyl)-4-nitropyridine-2-sulfonyl chloride
CID 131491229
4-chloro-6-(difluoromethyl)-3-hydroxypyridine-2-sulfonyl chloride
CID 130072883
6-(difluoromethyl)-4-iodo-3-methylpyridine-2-sulfonyl chloride
CID 130086391
4-amino-2-chloro-6-(difluoromethyl)pyridine-3-sulfonamide
CID 130103127
6-amino-5-chloro-3-(difluoromethyl)pyridine-2-sulfonyl chloride
CID 130103054
3-chloro-6-(difluoromethyl)-4-nitropyridine-2-sulfonyl chloride
CID 131446537
3,5-dibromo-6-(difluoromethyl)pyridine-2-sulfonyl chloride
CID 130099148
5-amino-2-(difluoromethyl)pyridine-4-sulfonyl chloride
CID 130094958
2-amino-4-bromo-6-(difluoromethyl)pyridine-3-sulfonamide
CID 130102336
3-chloro-6-(difluoromethyl)-4-fluoropyridine-2-sulfonamide
CID 134663670

Frequently Asked Questions

What is the IUPAC name of 4-amino-3-bromo-6-(difluoromethyl)pyridine-2-sulfonyl chloride?
The IUPAC name of 4-amino-3-bromo-6-(difluoromethyl)pyridine-2-sulfonyl chloride (CID 118817000) is 4-amino-3-bromo-6-(difluoromethyl)pyridine-2-sulfonyl chloride.
What is the SMILES notation for 4-amino-3-bromo-6-(difluoromethyl)pyridine-2-sulfonyl chloride?
The canonical SMILES for 4-amino-3-bromo-6-(difluoromethyl)pyridine-2-sulfonyl chloride is Nc1cc(C(F)F)nc(S(=O)(=O)Cl)c1Br.
What is the InChIKey of 4-amino-3-bromo-6-(difluoromethyl)pyridine-2-sulfonyl chloride?
The InChIKey is YUDWDHYRICCFNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H4BrClF2N2O2S/c7-4-2(11)1-3(5(9)10)12-6(4)15(8,13)14/h1,5H,(H2,11,12).
What are the key properties of 4-amino-3-bromo-6-(difluoromethyl)pyridine-2-sulfonyl chloride?
4-amino-3-bromo-6-(difluoromethyl)pyridine-2-sulfonyl chloride has a molecular weight of 321.53 g/mol, XLogP of 2.29, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-3-bromo-6-(difluoromethyl)pyridine-2-sulfonyl chloride is sourced from PubChem (CID 118817000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).