5-bromo-N-(4-bromo-3-fluorophenyl)-2-hydrazinylpyridine-3-sulfonamide

C11H9Br2FN4O2S — CID 65436185

IUPAC5-bromo-N-(4-bromo-3-fluorophenyl)-2-hydrazinylpyridine-3-sulfonamide
SMILESNNc1ncc(Br)cc1S(=O)(=O)Nc1ccc(Br)c(F)c1
InChIInChI=1S/C11H9Br2FN4O2S/c12-6-3-10(11(17-15)16-5-6)21(19,20)18-7-1-2-8(13)9(14)4-7/h1-5,18H,15H2,(H,16,17)
InChIKeyGTMNYMAUMLSUGX-UHFFFAOYSA-N
MW440.09 g/mol
LogP2.83
Rot. Bonds4

About 5-bromo-N-(4-bromo-3-fluorophenyl)-2-hydrazinylpyridine-3-sulfonamide

5-bromo-N-(4-bromo-3-fluorophenyl)-2-hydrazinylpyridine-3-sulfonamide (PubChem CID 65436185) has the molecular formula C11H9Br2FN4O2S and a molecular weight of 440.09 g/mol. Its IUPAC name is 5-bromo-N-(4-bromo-3-fluorophenyl)-2-hydrazinylpyridine-3-sulfonamide.

Molecular Properties

Compound Name5-bromo-N-(4-bromo-3-fluorophenyl)-2-hydrazinylpyridine-3-sulfonamide
PubChem CID65436185
Molecular FormulaC11H9Br2FN4O2S
Molecular Weight440.09 g/mol
Exact Mass437.88
IUPAC Name5-bromo-N-(4-bromo-3-fluorophenyl)-2-hydrazinylpyridine-3-sulfonamide
SMILESNNc1ncc(Br)cc1S(=O)(=O)Nc1ccc(Br)c(F)c1
InChIInChI=1S/C11H9Br2FN4O2S/c12-6-3-10(11(17-15)16-5-6)21(19,20)18-7-1-2-8(13)9(14)4-7/h1-5,18H,15H2,(H,16,17)
InChIKeyGTMNYMAUMLSUGX-UHFFFAOYSA-N
XLogP2.83
TPSA97.11 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500440.09
LogP ≤ 52.83
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-(4-bromo-3-fluorophenyl)-2-hydrazinylpyrimidine-5-sulfonamide
CID 65436383
5-bromo-N-(3-ethylphenyl)-2-hydrazinylpyridine-3-sulfonamide
CID 61298536
5-bromo-N-(4-fluorophenyl)-2-(methylamino)pyridine-3-sulfonamide
CID 62143306
5-bromo-N-(3-bromo-4-fluorophenyl)-2-chloropyridine-3-sulfonamide
CID 104777158
5-bromo-N-[(4-fluorophenyl)methyl]-2-hydrazinylpyridine-3-sulfonamide
CID 61298529
5-bromo-2-hydrazinyl-N',N'-dimethylpyridine-3-sulfonohydrazide
CID 83025691
2-amino-5-bromo-N-(3,4,5-trifluorophenyl)pyridine-3-sulfonamide
CID 62813648
2-bromo-N-(4-bromo-3-fluorophenyl)-4-methylbenzenesulfonamide
CID 65436218
2-(aminomethyl)-N-(4-bromo-3-fluorophenyl)-5-fluorobenzenesulfonamide
CID 106067079
N-(4-chloro-3-fluorophenyl)-2-hydrazinylpyridine-3-sulfonamide
CID 61468313
4-amino-N-(4-bromo-3-fluorophenyl)benzenesulfonamide
CID 50998348
N-(4-bromo-3-fluorophenyl)-2-chloro-5-fluorobenzenesulfonamide
CID 115649180

Frequently Asked Questions

What is the IUPAC name of 5-bromo-N-(4-bromo-3-fluorophenyl)-2-hydrazinylpyridine-3-sulfonamide?
The IUPAC name of 5-bromo-N-(4-bromo-3-fluorophenyl)-2-hydrazinylpyridine-3-sulfonamide (CID 65436185) is 5-bromo-N-(4-bromo-3-fluorophenyl)-2-hydrazinylpyridine-3-sulfonamide.
What is the SMILES notation for 5-bromo-N-(4-bromo-3-fluorophenyl)-2-hydrazinylpyridine-3-sulfonamide?
The canonical SMILES for 5-bromo-N-(4-bromo-3-fluorophenyl)-2-hydrazinylpyridine-3-sulfonamide is NNc1ncc(Br)cc1S(=O)(=O)Nc1ccc(Br)c(F)c1.
What is the InChIKey of 5-bromo-N-(4-bromo-3-fluorophenyl)-2-hydrazinylpyridine-3-sulfonamide?
The InChIKey is GTMNYMAUMLSUGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9Br2FN4O2S/c12-6-3-10(11(17-15)16-5-6)21(19,20)18-7-1-2-8(13)9(14)4-7/h1-5,18H,15H2,(H,16,17).
What are the key properties of 5-bromo-N-(4-bromo-3-fluorophenyl)-2-hydrazinylpyridine-3-sulfonamide?
5-bromo-N-(4-bromo-3-fluorophenyl)-2-hydrazinylpyridine-3-sulfonamide has a molecular weight of 440.09 g/mol, XLogP of 2.83, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-N-(4-bromo-3-fluorophenyl)-2-hydrazinylpyridine-3-sulfonamide is sourced from PubChem (CID 65436185), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).