5-bromothiophene-2-sulfonohydrazide

C4H5BrN2O2S2 — CID 23464136

IUPAC5-bromothiophene-2-sulfonohydrazide
SMILESNNS(=O)(=O)c1ccc(Br)s1
InChIInChI=1S/C4H5BrN2O2S2/c5-3-1-2-4(10-3)11(8,9)7-6/h1-2,7H,6H2
InChIKeyYDKSVYFORCNNHX-UHFFFAOYSA-N
MW257.13 g/mol
LogP0.66
Rot. Bonds2

About 5-bromothiophene-2-sulfonohydrazide

5-bromothiophene-2-sulfonohydrazide (PubChem CID 23464136) has the molecular formula C4H5BrN2O2S2 and a molecular weight of 257.13 g/mol. Its IUPAC name is 5-bromothiophene-2-sulfonohydrazide.

Molecular Properties

Compound Name5-bromothiophene-2-sulfonohydrazide
PubChem CID23464136
Molecular FormulaC4H5BrN2O2S2
Molecular Weight257.13 g/mol
Exact Mass255.90
IUPAC Name5-bromothiophene-2-sulfonohydrazide
SMILESNNS(=O)(=O)c1ccc(Br)s1
InChIInChI=1S/C4H5BrN2O2S2/c5-3-1-2-4(10-3)11(8,9)7-6/h1-2,7H,6H2
InChIKeyYDKSVYFORCNNHX-UHFFFAOYSA-N
XLogP0.66
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.13
LogP ≤ 50.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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

N-(4-aminophenyl)-5-bromothiophene-2-sulfonamide
CID 43166676
5-bromo-N-[(2R)-butan-2-yl]thiophene-2-sulfonamide
CID 848230
[(5-bromothiophen-2-yl)sulfonylamino]thiourea
CID 65214417
N-(2-aminooxyethyl)-5-bromothiophene-2-sulfonamide
CID 39423764
2-[(5-bromothiophen-2-yl)sulfonylamino]-2-methylpropanamide
CID 61392292
5-bromo-N-[4-(methanesulfonamido)phenyl]thiophene-2-sulfonamide
CID 31073677
5-bromo-N-(1,3-dihydroxypropan-2-yl)thiophene-2-sulfonamide
CID 65314645
5-bromo-N-cyclopentylthiophene-2-sulfonamide
CID 893383
N-benzyl-5-bromothiophene-2-sulfonamide
CID 848221
5-bromo-N-(2,4-dibromophenyl)thiophene-2-sulfonamide
CID 22773592
5-bromo-N-cyclooctylthiophene-2-sulfonamide
CID 19681116
5-bromo-N-(2-methylbutan-2-yl)thiophene-2-sulfonamide
CID 19682083

Frequently Asked Questions

What is the IUPAC name of 5-bromothiophene-2-sulfonohydrazide?
The IUPAC name of 5-bromothiophene-2-sulfonohydrazide (CID 23464136) is 5-bromothiophene-2-sulfonohydrazide.
What is the SMILES notation for 5-bromothiophene-2-sulfonohydrazide?
The canonical SMILES for 5-bromothiophene-2-sulfonohydrazide is NNS(=O)(=O)c1ccc(Br)s1.
What is the InChIKey of 5-bromothiophene-2-sulfonohydrazide?
The InChIKey is YDKSVYFORCNNHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H5BrN2O2S2/c5-3-1-2-4(10-3)11(8,9)7-6/h1-2,7H,6H2.
What are the key properties of 5-bromothiophene-2-sulfonohydrazide?
5-bromothiophene-2-sulfonohydrazide has a molecular weight of 257.13 g/mol, XLogP of 0.66, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromothiophene-2-sulfonohydrazide is sourced from PubChem (CID 23464136), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).