5-bromo-2-(methylamino)-N-pyridazin-3-ylpyridine-3-sulfonamide

C10H10BrN5O2S — CID 116787819

IUPAC5-bromo-2-(methylamino)-N-pyridazin-3-ylpyridine-3-sulfonamide
SMILESCNc1ncc(Br)cc1S(=O)(=O)Nc1cccnn1
InChIInChI=1S/C10H10BrN5O2S/c1-12-10-8(5-7(11)6-13-10)19(17,18)16-9-3-2-4-14-15-9/h2-6H,1H3,(H,12,13)(H,15,16)
InChIKeyIXBJBMQOQHLSKX-UHFFFAOYSA-N
MW344.19 g/mol
LogP1.48
Rot. Bonds4

About 5-bromo-2-(methylamino)-N-pyridazin-3-ylpyridine-3-sulfonamide

5-bromo-2-(methylamino)-N-pyridazin-3-ylpyridine-3-sulfonamide (PubChem CID 116787819) has the molecular formula C10H10BrN5O2S and a molecular weight of 344.19 g/mol. Its IUPAC name is 5-bromo-2-(methylamino)-N-pyridazin-3-ylpyridine-3-sulfonamide.

Molecular Properties

Compound Name5-bromo-2-(methylamino)-N-pyridazin-3-ylpyridine-3-sulfonamide
PubChem CID116787819
Molecular FormulaC10H10BrN5O2S
Molecular Weight344.19 g/mol
Exact Mass342.97
IUPAC Name5-bromo-2-(methylamino)-N-pyridazin-3-ylpyridine-3-sulfonamide
SMILESCNc1ncc(Br)cc1S(=O)(=O)Nc1cccnn1
InChIInChI=1S/C10H10BrN5O2S/c1-12-10-8(5-7(11)6-13-10)19(17,18)16-9-3-2-4-14-15-9/h2-6H,1H3,(H,12,13)(H,15,16)
InChIKeyIXBJBMQOQHLSKX-UHFFFAOYSA-N
XLogP1.48
TPSA96.87 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.19
LogP ≤ 51.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 5-bromo-2-(methylamino)-N-pyridazin-3-ylpyridine-3-sulfonamide 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-2-(ethylamino)-N-pyridazin-3-ylpyridine-3-sulfonamide
CID 116787807
5-bromo-N-(2,6-dichlorophenyl)-2-(methylamino)pyridine-3-sulfonamide
CID 65498877
5-bromo-N-(5-bromo-4-methyl-2-pyridinyl)-2-(methylamino)pyridine-3-sulfonamide
CID 79736645
5-bromo-N-(4-fluorophenyl)-2-(methylamino)pyridine-3-sulfonamide
CID 62143306
5-bromo-N-(4-bromo-2-methylphenyl)-2-(methylamino)pyridine-3-sulfonamide
CID 62163010
5-bromo-N-(3-methoxyphenyl)-2-(methylamino)pyridine-3-sulfonamide
CID 62144727
5-bromo-2-(methylamino)-N-(3-methylsulfanylphenyl)pyridine-3-sulfonamide
CID 62164045
5-bromo-N-(2-bromo-4-chlorophenyl)-2-(methylamino)pyridine-3-sulfonamide
CID 81280690
3-amino-5-chloro-2-methyl-N-pyridazin-3-ylbenzenesulfonamide
CID 114380364
2-[[5-bromo-2-(methylamino)-3-pyridinyl]sulfonylamino]acetamide
CID 62149019
5-bromo-N-(3,4-dimethyl-1,2-oxazol-5-yl)-2-(methylamino)pyridine-3-sulfonamide
CID 65480779
5-bromo-2-(methylamino)-N-(2,2,3,3-tetramethylcyclopropyl)pyridine-3-sulfonamide
CID 79356421

Frequently Asked Questions

What is the IUPAC name of 5-bromo-2-(methylamino)-N-pyridazin-3-ylpyridine-3-sulfonamide?
The IUPAC name of 5-bromo-2-(methylamino)-N-pyridazin-3-ylpyridine-3-sulfonamide (CID 116787819) is 5-bromo-2-(methylamino)-N-pyridazin-3-ylpyridine-3-sulfonamide.
What is the SMILES notation for 5-bromo-2-(methylamino)-N-pyridazin-3-ylpyridine-3-sulfonamide?
The canonical SMILES for 5-bromo-2-(methylamino)-N-pyridazin-3-ylpyridine-3-sulfonamide is CNc1ncc(Br)cc1S(=O)(=O)Nc1cccnn1.
What is the InChIKey of 5-bromo-2-(methylamino)-N-pyridazin-3-ylpyridine-3-sulfonamide?
The InChIKey is IXBJBMQOQHLSKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10BrN5O2S/c1-12-10-8(5-7(11)6-13-10)19(17,18)16-9-3-2-4-14-15-9/h2-6H,1H3,(H,12,13)(H,15,16).
What are the key properties of 5-bromo-2-(methylamino)-N-pyridazin-3-ylpyridine-3-sulfonamide?
5-bromo-2-(methylamino)-N-pyridazin-3-ylpyridine-3-sulfonamide has a molecular weight of 344.19 g/mol, XLogP of 1.48, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-2-(methylamino)-N-pyridazin-3-ylpyridine-3-sulfonamide is sourced from PubChem (CID 116787819), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).