4-bromo-6-(difluoromethyl)-2-methoxypyridine-3-sulfonamide

C7H7BrF2N2O3S — CID 118850937

IUPAC4-bromo-6-(difluoromethyl)-2-methoxypyridine-3-sulfonamide
SMILESCOc1nc(C(F)F)cc(Br)c1S(N)(=O)=O
InChIInChI=1S/C7H7BrF2N2O3S/c1-15-7-5(16(11,13)14)3(8)2-4(12-7)6(9)10/h2,6H,1H3,(H2,11,13,14)
InChIKeyOTXQNHPKXYCPAU-UHFFFAOYSA-N
MW317.11 g/mol
LogP1.44
Rot. Bonds3

About 4-bromo-6-(difluoromethyl)-2-methoxypyridine-3-sulfonamide

4-bromo-6-(difluoromethyl)-2-methoxypyridine-3-sulfonamide (PubChem CID 118850937) has the molecular formula C7H7BrF2N2O3S and a molecular weight of 317.11 g/mol. Its IUPAC name is 4-bromo-6-(difluoromethyl)-2-methoxypyridine-3-sulfonamide.

Molecular Properties

Compound Name4-bromo-6-(difluoromethyl)-2-methoxypyridine-3-sulfonamide
PubChem CID118850937
Molecular FormulaC7H7BrF2N2O3S
Molecular Weight317.11 g/mol
Exact Mass315.93
IUPAC Name4-bromo-6-(difluoromethyl)-2-methoxypyridine-3-sulfonamide
SMILESCOc1nc(C(F)F)cc(Br)c1S(N)(=O)=O
InChIInChI=1S/C7H7BrF2N2O3S/c1-15-7-5(16(11,13)14)3(8)2-4(12-7)6(9)10/h2,6H,1H3,(H2,11,13,14)
InChIKeyOTXQNHPKXYCPAU-UHFFFAOYSA-N
XLogP1.44
TPSA82.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.11
LogP ≤ 51.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-amino-6-(difluoromethyl)-2-methoxypyridine-3-sulfonamide
CID 118817873
2-amino-4-bromo-6-(difluoromethyl)pyridine-3-sulfonamide
CID 130102336
6-(difluoromethyl)-3-fluoro-2-methoxypyridine-4-sulfonamide
CID 133105136
3-bromo-5-(difluoromethyl)-6-methoxypyridine-2-sulfonamide
CID 130069062
3-bromo-6-(difluoromethyl)-4-fluoro-2-methoxypyridine
CID 130109372
2-amino-6-(difluoromethyl)-4-methylpyridine-3-sulfonamide
CID 118995995
3-bromo-6-(difluoromethyl)-2-methylpyridine-4-sulfonamide
CID 130069661
6-bromo-4-(difluoromethyl)-5-methoxypyridine-2-sulfonamide
CID 130069038
5-chloro-3-(difluoromethyl)-6-methoxypyridine-2-sulfonamide
CID 134669477
2-(difluoromethyl)-6-methoxy-5-methylpyridine-3-sulfonamide
CID 119025071
6-(difluoromethyl)-3-methoxy-2-methylpyridine-4-sulfonamide
CID 133098978
3-bromo-4-(chloromethyl)-6-(difluoromethyl)-2-methoxypyridine
CID 130068796

Frequently Asked Questions

What is the IUPAC name of 4-bromo-6-(difluoromethyl)-2-methoxypyridine-3-sulfonamide?
The IUPAC name of 4-bromo-6-(difluoromethyl)-2-methoxypyridine-3-sulfonamide (CID 118850937) is 4-bromo-6-(difluoromethyl)-2-methoxypyridine-3-sulfonamide.
What is the SMILES notation for 4-bromo-6-(difluoromethyl)-2-methoxypyridine-3-sulfonamide?
The canonical SMILES for 4-bromo-6-(difluoromethyl)-2-methoxypyridine-3-sulfonamide is COc1nc(C(F)F)cc(Br)c1S(N)(=O)=O.
What is the InChIKey of 4-bromo-6-(difluoromethyl)-2-methoxypyridine-3-sulfonamide?
The InChIKey is OTXQNHPKXYCPAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7BrF2N2O3S/c1-15-7-5(16(11,13)14)3(8)2-4(12-7)6(9)10/h2,6H,1H3,(H2,11,13,14).
What are the key properties of 4-bromo-6-(difluoromethyl)-2-methoxypyridine-3-sulfonamide?
4-bromo-6-(difluoromethyl)-2-methoxypyridine-3-sulfonamide has a molecular weight of 317.11 g/mol, XLogP of 1.44, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-bromo-6-(difluoromethyl)-2-methoxypyridine-3-sulfonamide is sourced from PubChem (CID 118850937), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).