N-(5-bromo-1,3-thiazol-2-yl)-2-hydrazinylpyridine-4-sulfonamide

C8H8BrN5O2S2 — CID 61004029

IUPACN-(5-bromo-1,3-thiazol-2-yl)-2-hydrazinylpyridine-4-sulfonamide
SMILESNNc1cc(S(=O)(=O)Nc2ncc(Br)s2)ccn1
InChIInChI=1S/C8H8BrN5O2S2/c9-6-4-12-8(17-6)14-18(15,16)5-1-2-11-7(3-5)13-10/h1-4H,10H2,(H,11,13)(H,12,14)
InChIKeyGGEVRWDQWNEHFJ-UHFFFAOYSA-N
MW350.22 g/mol
LogP1.39
Rot. Bonds4

About N-(5-bromo-1,3-thiazol-2-yl)-2-hydrazinylpyridine-4-sulfonamide

N-(5-bromo-1,3-thiazol-2-yl)-2-hydrazinylpyridine-4-sulfonamide (PubChem CID 61004029) has the molecular formula C8H8BrN5O2S2 and a molecular weight of 350.22 g/mol. Its IUPAC name is N-(5-bromo-1,3-thiazol-2-yl)-2-hydrazinylpyridine-4-sulfonamide.

Molecular Properties

Compound NameN-(5-bromo-1,3-thiazol-2-yl)-2-hydrazinylpyridine-4-sulfonamide
PubChem CID61004029
Molecular FormulaC8H8BrN5O2S2
Molecular Weight350.22 g/mol
Exact Mass348.93
IUPAC NameN-(5-bromo-1,3-thiazol-2-yl)-2-hydrazinylpyridine-4-sulfonamide
SMILESNNc1cc(S(=O)(=O)Nc2ncc(Br)s2)ccn1
InChIInChI=1S/C8H8BrN5O2S2/c9-6-4-12-8(17-6)14-18(15,16)5-1-2-11-7(3-5)13-10/h1-4H,10H2,(H,11,13)(H,12,14)
InChIKeyGGEVRWDQWNEHFJ-UHFFFAOYSA-N
XLogP1.39
TPSA110.00 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.22
LogP ≤ 51.39
H-Bond Donors ≤ 53
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

2-hydrazinyl-N-(thiatriazol-5-yl)pyridine-4-sulfonamide
CID 114912904
4-bromo-N-(5-bromo-1,3-thiazol-2-yl)-3-fluorobenzenesulfonamide
CID 107649952
N-(5-bromo-1,3-thiazol-2-yl)-4-hydroxybenzenesulfonamide
CID 60785748
N-(3-bromo-5-methylphenyl)-2-hydrazinylpyridine-4-sulfonamide
CID 107584202
N-(5-bromo-1,3-thiazol-2-yl)-2,3-dihydro-1,4-benzodioxine-6-sulfonamide
CID 60784344
4-[(5-bromo-1,3-thiazol-2-yl)sulfamoyl]-2-methylbenzenecarbothioamide
CID 106920069
N-(5-bromo-1,3-thiazol-2-yl)-4-hydroxy-3-nitrobenzenesulfonamide
CID 60785749
2-hydrazinyl-N-(2-iodophenyl)pyridine-4-sulfonamide
CID 54895973
N-(3,4-difluorophenyl)-2-hydrazinylpyridine-4-sulfonamide
CID 61004703
2-hydrazinyl-N-(6-methoxy-3-pyridinyl)pyridine-4-sulfonamide
CID 61004702
N-(5-bromo-1,3-thiazol-2-yl)-6-(ethylamino)pyridine-3-sulfonamide
CID 62147032
5-[(5-bromo-1,3-thiazol-2-yl)sulfamoyl]-2-methoxybenzoic acid
CID 60784641

Frequently Asked Questions

What is the IUPAC name of N-(5-bromo-1,3-thiazol-2-yl)-2-hydrazinylpyridine-4-sulfonamide?
The IUPAC name of N-(5-bromo-1,3-thiazol-2-yl)-2-hydrazinylpyridine-4-sulfonamide (CID 61004029) is N-(5-bromo-1,3-thiazol-2-yl)-2-hydrazinylpyridine-4-sulfonamide.
What is the SMILES notation for N-(5-bromo-1,3-thiazol-2-yl)-2-hydrazinylpyridine-4-sulfonamide?
The canonical SMILES for N-(5-bromo-1,3-thiazol-2-yl)-2-hydrazinylpyridine-4-sulfonamide is NNc1cc(S(=O)(=O)Nc2ncc(Br)s2)ccn1.
What is the InChIKey of N-(5-bromo-1,3-thiazol-2-yl)-2-hydrazinylpyridine-4-sulfonamide?
The InChIKey is GGEVRWDQWNEHFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8BrN5O2S2/c9-6-4-12-8(17-6)14-18(15,16)5-1-2-11-7(3-5)13-10/h1-4H,10H2,(H,11,13)(H,12,14).
What are the key properties of N-(5-bromo-1,3-thiazol-2-yl)-2-hydrazinylpyridine-4-sulfonamide?
N-(5-bromo-1,3-thiazol-2-yl)-2-hydrazinylpyridine-4-sulfonamide has a molecular weight of 350.22 g/mol, XLogP of 1.39, 4 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-bromo-1,3-thiazol-2-yl)-2-hydrazinylpyridine-4-sulfonamide is sourced from PubChem (CID 61004029), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).