5-chloro-6-hydrazinyl-N-(6-oxo-1H-pyridazin-3-yl)pyridine-3-sulfonamide

C9H9ClN6O3S — CID 116787309

IUPAC5-chloro-6-hydrazinyl-N-(6-oxo-1H-pyridazin-3-yl)pyridine-3-sulfonamide
SMILESNNc1ncc(S(=O)(=O)Nc2ccc(=O)[nH]n2)cc1Cl
InChIInChI=1S/C9H9ClN6O3S/c10-6-3-5(4-12-9(6)13-11)20(18,19)16-7-1-2-8(17)15-14-7/h1-4H,11H2,(H,12,13)(H,14,16)(H,15,17)
InChIKeyWBEOUXUBOUOUIP-UHFFFAOYSA-N
MW316.73 g/mol
LogP-0.10
Rot. Bonds4

About 5-chloro-6-hydrazinyl-N-(6-oxo-1H-pyridazin-3-yl)pyridine-3-sulfonamide

5-chloro-6-hydrazinyl-N-(6-oxo-1H-pyridazin-3-yl)pyridine-3-sulfonamide (PubChem CID 116787309) has the molecular formula C9H9ClN6O3S and a molecular weight of 316.73 g/mol. Its IUPAC name is 5-chloro-6-hydrazinyl-N-(6-oxo-1H-pyridazin-3-yl)pyridine-3-sulfonamide.

Molecular Properties

Compound Name5-chloro-6-hydrazinyl-N-(6-oxo-1H-pyridazin-3-yl)pyridine-3-sulfonamide
PubChem CID116787309
Molecular FormulaC9H9ClN6O3S
Molecular Weight316.73 g/mol
Exact Mass316.01
IUPAC Name5-chloro-6-hydrazinyl-N-(6-oxo-1H-pyridazin-3-yl)pyridine-3-sulfonamide
SMILESNNc1ncc(S(=O)(=O)Nc2ccc(=O)[nH]n2)cc1Cl
InChIInChI=1S/C9H9ClN6O3S/c10-6-3-5(4-12-9(6)13-11)20(18,19)16-7-1-2-8(17)15-14-7/h1-4H,11H2,(H,12,13)(H,14,16)(H,15,17)
InChIKeyWBEOUXUBOUOUIP-UHFFFAOYSA-N
XLogP-0.10
TPSA142.86 Ų
H-Bond Donors4
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.73
LogP ≤ 5-0.10
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 107

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

5-chloro-6-hydrazinyl-N-pyridazin-3-ylpyridine-3-sulfonamide
CID 116787298
5-chloro-6-hydrazinyl-N-pyrimidin-2-ylpyridine-3-sulfonamide
CID 64608544
N-(4-bromophenyl)-5-chloro-6-hydrazinylpyridine-3-sulfonamide
CID 64607594
5-chloro-N-(5-chloro-2-fluorophenyl)-6-hydrazinylpyridine-3-sulfonamide
CID 64608935
5-chloro-N-(2,4-dibromophenyl)-6-hydrazinylpyridine-3-sulfonamide
CID 64609135
5-chloro-N-(3,4-difluorophenyl)-6-hydrazinylpyridine-3-sulfonamide
CID 64606448
5-chloro-N-(2-chloro-4-methylphenyl)-6-hydrazinylpyridine-3-sulfonamide
CID 64608552
5-chloro-6-hydrazinyl-N-(4-methylsulfanylphenyl)pyridine-3-sulfonamide
CID 64607396
5-chloro-6-hydrazinyl-N-(2-methyl-4-pyridinyl)pyridine-3-sulfonamide
CID 79240791
5-chloro-6-hydrazinyl-N-(1,2,4-triazin-3-yl)pyridine-3-sulfonamide
CID 114388272
5-chloro-N-(2-ethylphenyl)-6-hydrazinylpyridine-3-sulfonamide
CID 64609120
4-(aminomethyl)-N-(6-oxo-1H-pyridazin-3-yl)benzenesulfonamide
CID 116786577

Frequently Asked Questions

What is the IUPAC name of 5-chloro-6-hydrazinyl-N-(6-oxo-1H-pyridazin-3-yl)pyridine-3-sulfonamide?
The IUPAC name of 5-chloro-6-hydrazinyl-N-(6-oxo-1H-pyridazin-3-yl)pyridine-3-sulfonamide (CID 116787309) is 5-chloro-6-hydrazinyl-N-(6-oxo-1H-pyridazin-3-yl)pyridine-3-sulfonamide.
What is the SMILES notation for 5-chloro-6-hydrazinyl-N-(6-oxo-1H-pyridazin-3-yl)pyridine-3-sulfonamide?
The canonical SMILES for 5-chloro-6-hydrazinyl-N-(6-oxo-1H-pyridazin-3-yl)pyridine-3-sulfonamide is NNc1ncc(S(=O)(=O)Nc2ccc(=O)[nH]n2)cc1Cl.
What is the InChIKey of 5-chloro-6-hydrazinyl-N-(6-oxo-1H-pyridazin-3-yl)pyridine-3-sulfonamide?
The InChIKey is WBEOUXUBOUOUIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9ClN6O3S/c10-6-3-5(4-12-9(6)13-11)20(18,19)16-7-1-2-8(17)15-14-7/h1-4H,11H2,(H,12,13)(H,14,16)(H,15,17).
What are the key properties of 5-chloro-6-hydrazinyl-N-(6-oxo-1H-pyridazin-3-yl)pyridine-3-sulfonamide?
5-chloro-6-hydrazinyl-N-(6-oxo-1H-pyridazin-3-yl)pyridine-3-sulfonamide has a molecular weight of 316.73 g/mol, XLogP of -0.10, 4 rotatable bonds, 4 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-6-hydrazinyl-N-(6-oxo-1H-pyridazin-3-yl)pyridine-3-sulfonamide is sourced from PubChem (CID 116787309), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).