3-chloro-N-(2-sulfamoylphenyl)thiophene-2-sulfonamide

C10H9ClN2O4S3 — CID 174608242

IUPAC3-chloro-N-(2-sulfamoylphenyl)thiophene-2-sulfonamide
SMILESNS(=O)(=O)c1ccccc1NS(=O)(=O)c1sccc1Cl
InChIInChI=1S/C10H9ClN2O4S3/c11-7-5-6-18-10(7)20(16,17)13-8-3-1-2-4-9(8)19(12,14)15/h1-6,13H,(H2,12,14,15)
InChIKeyRESFYWDTZCXBJC-UHFFFAOYSA-N
MW352.85 g/mol
LogP1.85
Rot. Bonds4

About 3-chloro-N-(2-sulfamoylphenyl)thiophene-2-sulfonamide

3-chloro-N-(2-sulfamoylphenyl)thiophene-2-sulfonamide (PubChem CID 174608242) has the molecular formula C10H9ClN2O4S3 and a molecular weight of 352.85 g/mol. Its IUPAC name is 3-chloro-N-(2-sulfamoylphenyl)thiophene-2-sulfonamide.

Molecular Properties

Compound Name3-chloro-N-(2-sulfamoylphenyl)thiophene-2-sulfonamide
PubChem CID174608242
Molecular FormulaC10H9ClN2O4S3
Molecular Weight352.85 g/mol
Exact Mass351.94
IUPAC Name3-chloro-N-(2-sulfamoylphenyl)thiophene-2-sulfonamide
SMILESNS(=O)(=O)c1ccccc1NS(=O)(=O)c1sccc1Cl
InChIInChI=1S/C10H9ClN2O4S3/c11-7-5-6-18-10(7)20(16,17)13-8-3-1-2-4-9(8)19(12,14)15/h1-6,13H,(H2,12,14,15)
InChIKeyRESFYWDTZCXBJC-UHFFFAOYSA-N
XLogP1.85
TPSA106.33 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.85
LogP ≤ 51.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3,5-dichloro-N-(2-sulfamoylphenyl)benzenesulfonamide
CID 47060111
2-[(3-bromothiophen-2-yl)sulfonylamino]benzenesulfonyl fluoride
CID 116814262
2-[(4-tert-butylphenyl)sulfonylamino]benzenesulfonamide
CID 11508929
N-[2-(aminomethyl)phenyl]-3-bromothiophene-2-sulfonamide
CID 64894470
3-bromo-N-(2,4,5-trichlorophenyl)thiophene-2-sulfonamide
CID 61456145
2-(difluoromethylsulfonylamino)benzenesulfonamide
CID 61132086
3,4-difluoro-N-(2-sulfamoylphenyl)benzenesulfonamide
CID 75526090
2-[(4-nitrophenyl)sulfonylamino]benzenesulfonamide
CID 68782623
2-[(3-methylphenyl)sulfonylamino]benzenesulfonamide
CID 57266876
1-(2-chlorophenyl)-3-(2-sulfamoylphenyl)urea
CID 61131953
N-(2-bromophenyl)-2-chlorobenzenesulfonamide
CID 4816661
3-bromo-N-(3-hydroxy-2-methylphenyl)thiophene-2-sulfonamide
CID 64793855

Frequently Asked Questions

What is the IUPAC name of 3-chloro-N-(2-sulfamoylphenyl)thiophene-2-sulfonamide?
The IUPAC name of 3-chloro-N-(2-sulfamoylphenyl)thiophene-2-sulfonamide (CID 174608242) is 3-chloro-N-(2-sulfamoylphenyl)thiophene-2-sulfonamide.
What is the SMILES notation for 3-chloro-N-(2-sulfamoylphenyl)thiophene-2-sulfonamide?
The canonical SMILES for 3-chloro-N-(2-sulfamoylphenyl)thiophene-2-sulfonamide is NS(=O)(=O)c1ccccc1NS(=O)(=O)c1sccc1Cl.
What is the InChIKey of 3-chloro-N-(2-sulfamoylphenyl)thiophene-2-sulfonamide?
The InChIKey is RESFYWDTZCXBJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9ClN2O4S3/c11-7-5-6-18-10(7)20(16,17)13-8-3-1-2-4-9(8)19(12,14)15/h1-6,13H,(H2,12,14,15).
What are the key properties of 3-chloro-N-(2-sulfamoylphenyl)thiophene-2-sulfonamide?
3-chloro-N-(2-sulfamoylphenyl)thiophene-2-sulfonamide has a molecular weight of 352.85 g/mol, XLogP of 1.85, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-N-(2-sulfamoylphenyl)thiophene-2-sulfonamide is sourced from PubChem (CID 174608242), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).