N-(4-bromo-2-fluorophenyl)-3-fluoropyridine-2-sulfonamide

C11H7BrF2N2O2S — CID 103299113

IUPACN-(4-bromo-2-fluorophenyl)-3-fluoropyridine-2-sulfonamide
SMILESO=S(=O)(Nc1ccc(Br)cc1F)c1ncccc1F
InChIInChI=1S/C11H7BrF2N2O2S/c12-7-3-4-10(9(14)6-7)16-19(17,18)11-8(13)2-1-5-15-11/h1-6,16H
InChIKeyHHMKDKXJTDPRGH-UHFFFAOYSA-N
MW349.16 g/mol
LogP2.92
Rot. Bonds3

About N-(4-bromo-2-fluorophenyl)-3-fluoropyridine-2-sulfonamide

N-(4-bromo-2-fluorophenyl)-3-fluoropyridine-2-sulfonamide (PubChem CID 103299113) has the molecular formula C11H7BrF2N2O2S and a molecular weight of 349.16 g/mol. Its IUPAC name is N-(4-bromo-2-fluorophenyl)-3-fluoropyridine-2-sulfonamide.

Molecular Properties

Compound NameN-(4-bromo-2-fluorophenyl)-3-fluoropyridine-2-sulfonamide
PubChem CID103299113
Molecular FormulaC11H7BrF2N2O2S
Molecular Weight349.16 g/mol
Exact Mass347.94
IUPAC NameN-(4-bromo-2-fluorophenyl)-3-fluoropyridine-2-sulfonamide
SMILESO=S(=O)(Nc1ccc(Br)cc1F)c1ncccc1F
InChIInChI=1S/C11H7BrF2N2O2S/c12-7-3-4-10(9(14)6-7)16-19(17,18)11-8(13)2-1-5-15-11/h1-6,16H
InChIKeyHHMKDKXJTDPRGH-UHFFFAOYSA-N
XLogP2.92
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.16
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(4-bromo-2-fluorophenyl)-3-fluoropyridine-2-sulfonamide?
The IUPAC name of N-(4-bromo-2-fluorophenyl)-3-fluoropyridine-2-sulfonamide (CID 103299113) is N-(4-bromo-2-fluorophenyl)-3-fluoropyridine-2-sulfonamide.
What is the SMILES notation for N-(4-bromo-2-fluorophenyl)-3-fluoropyridine-2-sulfonamide?
The canonical SMILES for N-(4-bromo-2-fluorophenyl)-3-fluoropyridine-2-sulfonamide is O=S(=O)(Nc1ccc(Br)cc1F)c1ncccc1F.
What is the InChIKey of N-(4-bromo-2-fluorophenyl)-3-fluoropyridine-2-sulfonamide?
The InChIKey is HHMKDKXJTDPRGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7BrF2N2O2S/c12-7-3-4-10(9(14)6-7)16-19(17,18)11-8(13)2-1-5-15-11/h1-6,16H.
What are the key properties of N-(4-bromo-2-fluorophenyl)-3-fluoropyridine-2-sulfonamide?
N-(4-bromo-2-fluorophenyl)-3-fluoropyridine-2-sulfonamide has a molecular weight of 349.16 g/mol, XLogP of 2.92, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-bromo-2-fluorophenyl)-3-fluoropyridine-2-sulfonamide is sourced from PubChem (CID 103299113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).