2-[(5-bromo-4-chlorothiophen-2-yl)sulfonylamino]oxyacetamide

C6H6BrClN2O4S2 — CID 112673433

IUPAC2-[(5-bromo-4-chlorothiophen-2-yl)sulfonylamino]oxyacetamide
SMILESNC(=O)CONS(=O)(=O)c1cc(Cl)c(Br)s1
InChIInChI=1S/C6H6BrClN2O4S2/c7-6-3(8)1-5(15-6)16(12,13)10-14-2-4(9)11/h1,10H,2H2,(H2,9,11)
InChIKeyPTVLDXWATSXQJG-UHFFFAOYSA-N
MW349.62 g/mol
LogP0.86
Rot. Bonds5

About 2-[(5-bromo-4-chlorothiophen-2-yl)sulfonylamino]oxyacetamide

2-[(5-bromo-4-chlorothiophen-2-yl)sulfonylamino]oxyacetamide (PubChem CID 112673433) has the molecular formula C6H6BrClN2O4S2 and a molecular weight of 349.62 g/mol. Its IUPAC name is 2-[(5-bromo-4-chlorothiophen-2-yl)sulfonylamino]oxyacetamide.

Molecular Properties

Compound Name2-[(5-bromo-4-chlorothiophen-2-yl)sulfonylamino]oxyacetamide
PubChem CID112673433
Molecular FormulaC6H6BrClN2O4S2
Molecular Weight349.62 g/mol
Exact Mass347.86
IUPAC Name2-[(5-bromo-4-chlorothiophen-2-yl)sulfonylamino]oxyacetamide
SMILESNC(=O)CONS(=O)(=O)c1cc(Cl)c(Br)s1
InChIInChI=1S/C6H6BrClN2O4S2/c7-6-3(8)1-5(15-6)16(12,13)10-14-2-4(9)11/h1,10H,2H2,(H2,9,11)
InChIKeyPTVLDXWATSXQJG-UHFFFAOYSA-N
XLogP0.86
TPSA98.49 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.62
LogP ≤ 50.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

methyl 3-[(5-bromo-4-chlorothiophen-2-yl)sulfonylamino]-2-chloropropanoate
CID 103493476
N-(5-bromo-4-chlorothiophen-2-yl)sulfonylacetamide
CID 80580140
2-[(2,5-dichlorophenyl)sulfonylamino]oxyacetamide
CID 112673471
5-[(2-amino-2-oxoethoxy)sulfamoyl]thiophene-3-carboxylic acid
CID 112672367
5-bromo-4-chloro-N-[(2R)-2-hydroxypropyl]thiophene-2-sulfonamide
CID 83030123
2-[(5-bromo-2-chloro-3-pyridinyl)sulfonylamino]oxyacetamide
CID 107856770
2-[[(5-bromo-4-chlorothiophen-2-yl)sulfonylamino]methyl]-3-methylbutanoic acid
CID 80577423
2-[(2-chloro-5-fluorophenyl)sulfonylamino]oxyacetamide
CID 105400000
(2R)-2-[(5-bromo-4-chlorothiophen-2-yl)sulfonylamino]butanoic acid
CID 80577604
2-[(5-bromo-4-chlorothiophen-2-yl)sulfonylamino]-2-cyclopropylethanethioamide
CID 80577614
5-bromo-4-chloro-N-(1-hydroxypropan-2-yl)thiophene-2-sulfonamide
CID 80577968
N-(1-aminopropan-2-yl)-5-bromo-4-chlorothiophene-2-sulfonamide
CID 80577776

Frequently Asked Questions

What is the IUPAC name of 2-[(5-bromo-4-chlorothiophen-2-yl)sulfonylamino]oxyacetamide?
The IUPAC name of 2-[(5-bromo-4-chlorothiophen-2-yl)sulfonylamino]oxyacetamide (CID 112673433) is 2-[(5-bromo-4-chlorothiophen-2-yl)sulfonylamino]oxyacetamide.
What is the SMILES notation for 2-[(5-bromo-4-chlorothiophen-2-yl)sulfonylamino]oxyacetamide?
The canonical SMILES for 2-[(5-bromo-4-chlorothiophen-2-yl)sulfonylamino]oxyacetamide is NC(=O)CONS(=O)(=O)c1cc(Cl)c(Br)s1.
What is the InChIKey of 2-[(5-bromo-4-chlorothiophen-2-yl)sulfonylamino]oxyacetamide?
The InChIKey is PTVLDXWATSXQJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6BrClN2O4S2/c7-6-3(8)1-5(15-6)16(12,13)10-14-2-4(9)11/h1,10H,2H2,(H2,9,11).
What are the key properties of 2-[(5-bromo-4-chlorothiophen-2-yl)sulfonylamino]oxyacetamide?
2-[(5-bromo-4-chlorothiophen-2-yl)sulfonylamino]oxyacetamide has a molecular weight of 349.62 g/mol, XLogP of 0.86, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5-bromo-4-chlorothiophen-2-yl)sulfonylamino]oxyacetamide is sourced from PubChem (CID 112673433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).