N-(5-chloro-2-methylsulfinylphenyl)thiophene-2-sulfonamide

C11H10ClNO3S3 — CID 67972821

IUPACN-(5-chloro-2-methylsulfinylphenyl)thiophene-2-sulfonamide
SMILESCS(=O)c1ccc(Cl)cc1NS(=O)(=O)c1cccs1
InChIInChI=1S/C11H10ClNO3S3/c1-18(14)10-5-4-8(12)7-9(10)13-19(15,16)11-3-2-6-17-11/h2-7,13H,1H3
InChIKeyQSLWHXUKQYHAJN-UHFFFAOYSA-N
MW335.86 g/mol
LogP2.94
Rot. Bonds4

About N-(5-chloro-2-methylsulfinylphenyl)thiophene-2-sulfonamide

N-(5-chloro-2-methylsulfinylphenyl)thiophene-2-sulfonamide (PubChem CID 67972821) has the molecular formula C11H10ClNO3S3 and a molecular weight of 335.86 g/mol. Its IUPAC name is N-(5-chloro-2-methylsulfinylphenyl)thiophene-2-sulfonamide.

Molecular Properties

Compound NameN-(5-chloro-2-methylsulfinylphenyl)thiophene-2-sulfonamide
PubChem CID67972821
Molecular FormulaC11H10ClNO3S3
Molecular Weight335.86 g/mol
Exact Mass334.95
IUPAC NameN-(5-chloro-2-methylsulfinylphenyl)thiophene-2-sulfonamide
SMILESCS(=O)c1ccc(Cl)cc1NS(=O)(=O)c1cccs1
InChIInChI=1S/C11H10ClNO3S3/c1-18(14)10-5-4-8(12)7-9(10)13-19(15,16)11-3-2-6-17-11/h2-7,13H,1H3
InChIKeyQSLWHXUKQYHAJN-UHFFFAOYSA-N
XLogP2.94
TPSA63.24 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.86
LogP ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[4,5-dichloro-2-[(2,5-dichlorophenyl)sulfonylamino]phenyl]thiophene-2-sulfonamide
CID 67970539
N-(5-chloro-2-methylsulfinylphenyl)-2,4-difluorobenzenesulfonamide
CID 57378877
N-[4,5-dichloro-2-[[4-(4-chlorophenyl)phenyl]sulfonylamino]phenyl]thiophene-2-sulfonamide
CID 67970196
N-(4-chloro-2-methoxy-5-methylphenyl)thiophene-2-sulfonamide
CID 8523500
N-(5-bromo-2-chlorophenyl)thiophene-2-sulfonamide
CID 55132063
4-methoxy-3-(thiophen-2-ylsulfonylamino)benzenesulfonyl chloride
CID 16771255
N-[4,5-dichloro-2-(thiophen-2-ylsulfonylamino)phenyl]-2,4-dimethyl-1,3-thiazole-5-sulfonamide
CID 57379871
N-(5-chloro-2-methylphenyl)-2-(thiophen-2-ylsulfonylamino)acetamide
CID 31973756
N-(2-chloro-3-pyridinyl)thiophene-2-sulfonamide
CID 2405422
N-(5-bromo-2-methylphenyl)thiophene-2-sulfonamide
CID 3864055
N-[4,5-dichloro-2-[(3-chloro-4-methylphenyl)sulfonylamino]phenyl]thiophene-2-sulfonamide
CID 67970049
N-(2-chloro-5-sulfamoylphenyl)thiophene-2-sulfonamide
CID 61132271

Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-methylsulfinylphenyl)thiophene-2-sulfonamide?
The IUPAC name of N-(5-chloro-2-methylsulfinylphenyl)thiophene-2-sulfonamide (CID 67972821) is N-(5-chloro-2-methylsulfinylphenyl)thiophene-2-sulfonamide.
What is the SMILES notation for N-(5-chloro-2-methylsulfinylphenyl)thiophene-2-sulfonamide?
The canonical SMILES for N-(5-chloro-2-methylsulfinylphenyl)thiophene-2-sulfonamide is CS(=O)c1ccc(Cl)cc1NS(=O)(=O)c1cccs1.
What is the InChIKey of N-(5-chloro-2-methylsulfinylphenyl)thiophene-2-sulfonamide?
The InChIKey is QSLWHXUKQYHAJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10ClNO3S3/c1-18(14)10-5-4-8(12)7-9(10)13-19(15,16)11-3-2-6-17-11/h2-7,13H,1H3.
What are the key properties of N-(5-chloro-2-methylsulfinylphenyl)thiophene-2-sulfonamide?
N-(5-chloro-2-methylsulfinylphenyl)thiophene-2-sulfonamide has a molecular weight of 335.86 g/mol, XLogP of 2.94, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-2-methylsulfinylphenyl)thiophene-2-sulfonamide is sourced from PubChem (CID 67972821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).