5-chloro-N-(5-chloro-2-fluorophenyl)-6-hydrazinylpyridine-3-sulfonamide

C11H9Cl2FN4O2S — CID 64608935

IUPAC5-chloro-N-(5-chloro-2-fluorophenyl)-6-hydrazinylpyridine-3-sulfonamide
SMILESNNc1ncc(S(=O)(=O)Nc2cc(Cl)ccc2F)cc1Cl
InChIInChI=1S/C11H9Cl2FN4O2S/c12-6-1-2-9(14)10(3-6)18-21(19,20)7-4-8(13)11(17-15)16-5-7/h1-5,18H,15H2,(H,16,17)
InChIKeyVUOGLYKDNJBUNF-UHFFFAOYSA-N
MW351.19 g/mol
LogP2.61
Rot. Bonds4

About 5-chloro-N-(5-chloro-2-fluorophenyl)-6-hydrazinylpyridine-3-sulfonamide

5-chloro-N-(5-chloro-2-fluorophenyl)-6-hydrazinylpyridine-3-sulfonamide (PubChem CID 64608935) has the molecular formula C11H9Cl2FN4O2S and a molecular weight of 351.19 g/mol. Its IUPAC name is 5-chloro-N-(5-chloro-2-fluorophenyl)-6-hydrazinylpyridine-3-sulfonamide.

Molecular Properties

Compound Name5-chloro-N-(5-chloro-2-fluorophenyl)-6-hydrazinylpyridine-3-sulfonamide
PubChem CID64608935
Molecular FormulaC11H9Cl2FN4O2S
Molecular Weight351.19 g/mol
Exact Mass349.98
IUPAC Name5-chloro-N-(5-chloro-2-fluorophenyl)-6-hydrazinylpyridine-3-sulfonamide
SMILESNNc1ncc(S(=O)(=O)Nc2cc(Cl)ccc2F)cc1Cl
InChIInChI=1S/C11H9Cl2FN4O2S/c12-6-1-2-9(14)10(3-6)18-21(19,20)7-4-8(13)11(17-15)16-5-7/h1-5,18H,15H2,(H,16,17)
InChIKeyVUOGLYKDNJBUNF-UHFFFAOYSA-N
XLogP2.61
TPSA97.11 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.19
LogP ≤ 52.61
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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Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-(5-chloro-2-fluorophenyl)-6-hydrazinylpyridine-3-sulfonamide?
The IUPAC name of 5-chloro-N-(5-chloro-2-fluorophenyl)-6-hydrazinylpyridine-3-sulfonamide (CID 64608935) is 5-chloro-N-(5-chloro-2-fluorophenyl)-6-hydrazinylpyridine-3-sulfonamide.
What is the SMILES notation for 5-chloro-N-(5-chloro-2-fluorophenyl)-6-hydrazinylpyridine-3-sulfonamide?
The canonical SMILES for 5-chloro-N-(5-chloro-2-fluorophenyl)-6-hydrazinylpyridine-3-sulfonamide is NNc1ncc(S(=O)(=O)Nc2cc(Cl)ccc2F)cc1Cl.
What is the InChIKey of 5-chloro-N-(5-chloro-2-fluorophenyl)-6-hydrazinylpyridine-3-sulfonamide?
The InChIKey is VUOGLYKDNJBUNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9Cl2FN4O2S/c12-6-1-2-9(14)10(3-6)18-21(19,20)7-4-8(13)11(17-15)16-5-7/h1-5,18H,15H2,(H,16,17).
What are the key properties of 5-chloro-N-(5-chloro-2-fluorophenyl)-6-hydrazinylpyridine-3-sulfonamide?
5-chloro-N-(5-chloro-2-fluorophenyl)-6-hydrazinylpyridine-3-sulfonamide has a molecular weight of 351.19 g/mol, XLogP of 2.61, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-(5-chloro-2-fluorophenyl)-6-hydrazinylpyridine-3-sulfonamide is sourced from PubChem (CID 64608935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).