N-(4-chloro-2-iodophenyl)-2-hydrazinylpyridine-3-sulfonamide

C11H10ClIN4O2S — CID 107626569

IUPACN-(4-chloro-2-iodophenyl)-2-hydrazinylpyridine-3-sulfonamide
SMILESNNc1ncccc1S(=O)(=O)Nc1ccc(Cl)cc1I
InChIInChI=1S/C11H10ClIN4O2S/c12-7-3-4-9(8(13)6-7)17-20(18,19)10-2-1-5-15-11(10)16-14/h1-6,17H,14H2,(H,15,16)
InChIKeyFPKJNYHVTFIMPC-UHFFFAOYSA-N
MW424.65 g/mol
LogP2.43
Rot. Bonds4

About N-(4-chloro-2-iodophenyl)-2-hydrazinylpyridine-3-sulfonamide

N-(4-chloro-2-iodophenyl)-2-hydrazinylpyridine-3-sulfonamide (PubChem CID 107626569) has the molecular formula C11H10ClIN4O2S and a molecular weight of 424.65 g/mol. Its IUPAC name is N-(4-chloro-2-iodophenyl)-2-hydrazinylpyridine-3-sulfonamide.

Molecular Properties

Compound NameN-(4-chloro-2-iodophenyl)-2-hydrazinylpyridine-3-sulfonamide
PubChem CID107626569
Molecular FormulaC11H10ClIN4O2S
Molecular Weight424.65 g/mol
Exact Mass423.93
IUPAC NameN-(4-chloro-2-iodophenyl)-2-hydrazinylpyridine-3-sulfonamide
SMILESNNc1ncccc1S(=O)(=O)Nc1ccc(Cl)cc1I
InChIInChI=1S/C11H10ClIN4O2S/c12-7-3-4-9(8(13)6-7)17-20(18,19)10-2-1-5-15-11(10)16-14/h1-6,17H,14H2,(H,15,16)
InChIKeyFPKJNYHVTFIMPC-UHFFFAOYSA-N
XLogP2.43
TPSA97.11 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500424.65
LogP ≤ 52.43
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'iodine', '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 N-(4-chloro-2-iodophenyl)-2-hydrazinylpyridine-3-sulfonamide?
The IUPAC name of N-(4-chloro-2-iodophenyl)-2-hydrazinylpyridine-3-sulfonamide (CID 107626569) is N-(4-chloro-2-iodophenyl)-2-hydrazinylpyridine-3-sulfonamide.
What is the SMILES notation for N-(4-chloro-2-iodophenyl)-2-hydrazinylpyridine-3-sulfonamide?
The canonical SMILES for N-(4-chloro-2-iodophenyl)-2-hydrazinylpyridine-3-sulfonamide is NNc1ncccc1S(=O)(=O)Nc1ccc(Cl)cc1I.
What is the InChIKey of N-(4-chloro-2-iodophenyl)-2-hydrazinylpyridine-3-sulfonamide?
The InChIKey is FPKJNYHVTFIMPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10ClIN4O2S/c12-7-3-4-9(8(13)6-7)17-20(18,19)10-2-1-5-15-11(10)16-14/h1-6,17H,14H2,(H,15,16).
What are the key properties of N-(4-chloro-2-iodophenyl)-2-hydrazinylpyridine-3-sulfonamide?
N-(4-chloro-2-iodophenyl)-2-hydrazinylpyridine-3-sulfonamide has a molecular weight of 424.65 g/mol, XLogP of 2.43, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chloro-2-iodophenyl)-2-hydrazinylpyridine-3-sulfonamide is sourced from PubChem (CID 107626569), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).