5-chloro-N-(2,4-dibromophenyl)-6-hydrazinylpyridine-3-sulfonamide

C11H9Br2ClN4O2S — CID 64609135

IUPAC5-chloro-N-(2,4-dibromophenyl)-6-hydrazinylpyridine-3-sulfonamide
SMILESNNc1ncc(S(=O)(=O)Nc2ccc(Br)cc2Br)cc1Cl
InChIInChI=1S/C11H9Br2ClN4O2S/c12-6-1-2-10(8(13)3-6)18-21(19,20)7-4-9(14)11(17-15)16-5-7/h1-5,18H,15H2,(H,16,17)
InChIKeyUJGBJGPCUFAFFP-UHFFFAOYSA-N
MW456.55 g/mol
LogP3.35
Rot. Bonds4

About 5-chloro-N-(2,4-dibromophenyl)-6-hydrazinylpyridine-3-sulfonamide

5-chloro-N-(2,4-dibromophenyl)-6-hydrazinylpyridine-3-sulfonamide (PubChem CID 64609135) has the molecular formula C11H9Br2ClN4O2S and a molecular weight of 456.55 g/mol. Its IUPAC name is 5-chloro-N-(2,4-dibromophenyl)-6-hydrazinylpyridine-3-sulfonamide.

Molecular Properties

Compound Name5-chloro-N-(2,4-dibromophenyl)-6-hydrazinylpyridine-3-sulfonamide
PubChem CID64609135
Molecular FormulaC11H9Br2ClN4O2S
Molecular Weight456.55 g/mol
Exact Mass453.85
IUPAC Name5-chloro-N-(2,4-dibromophenyl)-6-hydrazinylpyridine-3-sulfonamide
SMILESNNc1ncc(S(=O)(=O)Nc2ccc(Br)cc2Br)cc1Cl
InChIInChI=1S/C11H9Br2ClN4O2S/c12-6-1-2-10(8(13)3-6)18-21(19,20)7-4-9(14)11(17-15)16-5-7/h1-5,18H,15H2,(H,16,17)
InChIKeyUJGBJGPCUFAFFP-UHFFFAOYSA-N
XLogP3.35
TPSA97.11 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500456.55
LogP ≤ 53.35
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-(2,4-dibromophenyl)-6-hydrazinylpyridine-3-sulfonamide?
The IUPAC name of 5-chloro-N-(2,4-dibromophenyl)-6-hydrazinylpyridine-3-sulfonamide (CID 64609135) is 5-chloro-N-(2,4-dibromophenyl)-6-hydrazinylpyridine-3-sulfonamide.
What is the SMILES notation for 5-chloro-N-(2,4-dibromophenyl)-6-hydrazinylpyridine-3-sulfonamide?
The canonical SMILES for 5-chloro-N-(2,4-dibromophenyl)-6-hydrazinylpyridine-3-sulfonamide is NNc1ncc(S(=O)(=O)Nc2ccc(Br)cc2Br)cc1Cl.
What is the InChIKey of 5-chloro-N-(2,4-dibromophenyl)-6-hydrazinylpyridine-3-sulfonamide?
The InChIKey is UJGBJGPCUFAFFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9Br2ClN4O2S/c12-6-1-2-10(8(13)3-6)18-21(19,20)7-4-9(14)11(17-15)16-5-7/h1-5,18H,15H2,(H,16,17).
What are the key properties of 5-chloro-N-(2,4-dibromophenyl)-6-hydrazinylpyridine-3-sulfonamide?
5-chloro-N-(2,4-dibromophenyl)-6-hydrazinylpyridine-3-sulfonamide has a molecular weight of 456.55 g/mol, XLogP of 3.35, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-(2,4-dibromophenyl)-6-hydrazinylpyridine-3-sulfonamide is sourced from PubChem (CID 64609135), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).