5-chloro-N-[4-(sulfamoylmethyl)phenyl]thiophene-2-sulfonamide

C11H11ClN2O4S3 — CID 24650329

IUPAC5-chloro-N-[4-(sulfamoylmethyl)phenyl]thiophene-2-sulfonamide
SMILESNS(=O)(=O)Cc1ccc(NS(=O)(=O)c2ccc(Cl)s2)cc1
InChIInChI=1S/C11H11ClN2O4S3/c12-10-5-6-11(19-10)21(17,18)14-9-3-1-8(2-4-9)7-20(13,15)16/h1-6,14H,7H2,(H2,13,15,16)
InChIKeyMHNZPLGELVHIAG-UHFFFAOYSA-N
MW366.87 g/mol
LogP1.99
Rot. Bonds5

About 5-chloro-N-[4-(sulfamoylmethyl)phenyl]thiophene-2-sulfonamide

5-chloro-N-[4-(sulfamoylmethyl)phenyl]thiophene-2-sulfonamide (PubChem CID 24650329) has the molecular formula C11H11ClN2O4S3 and a molecular weight of 366.87 g/mol. Its IUPAC name is 5-chloro-N-[4-(sulfamoylmethyl)phenyl]thiophene-2-sulfonamide.

Molecular Properties

Compound Name5-chloro-N-[4-(sulfamoylmethyl)phenyl]thiophene-2-sulfonamide
PubChem CID24650329
Molecular FormulaC11H11ClN2O4S3
Molecular Weight366.87 g/mol
Exact Mass365.96
IUPAC Name5-chloro-N-[4-(sulfamoylmethyl)phenyl]thiophene-2-sulfonamide
SMILESNS(=O)(=O)Cc1ccc(NS(=O)(=O)c2ccc(Cl)s2)cc1
InChIInChI=1S/C11H11ClN2O4S3/c12-10-5-6-11(19-10)21(17,18)14-9-3-1-8(2-4-9)7-20(13,15)16/h1-6,14H,7H2,(H2,13,15,16)
InChIKeyMHNZPLGELVHIAG-UHFFFAOYSA-N
XLogP1.99
TPSA106.33 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.87
LogP ≤ 51.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-chloro-N-[4-(piperidin-1-ylmethyl)phenyl]thiophene-2-sulfonamide
CID 22205412
N-(4-bromo-3-iodophenyl)-5-chlorothiophene-2-sulfonamide
CID 114259633
5-chloro-N-[4-(2-phenylethylamino)phenyl]thiophene-2-sulfonamide
CID 112983289
4-[(5-chlorothiophen-2-yl)sulfonylamino]benzoate
CID 7040231
N-(6-amino-3-pyridinyl)-5-chlorothiophene-2-sulfonamide
CID 55025745
5-chloro-N-[4-(trifluoromethylsulfonyl)phenyl]thiophene-2-sulfonamide
CID 166200870
5-bromo-N-[4-(chloromethyl)phenyl]thiophene-2-sulfonamide
CID 65031324
1-[4-[(5-chlorothiophen-2-yl)sulfonylamino]phenyl]-3-[(4-fluorophenyl)methyl]urea
CID 44759858
N-(4-bromo-3-methylphenyl)-5-chlorothiophene-2-sulfonamide
CID 22774672
[4-(chloromethylsulfonylamino)phenyl]methanesulfonamide
CID 63666418
5-chloro-N-[4-(N-methylanilino)phenyl]thiophene-2-sulfonamide
CID 112986155
methyl 4-[[[2-[4-[(5-chlorothiophen-2-yl)sulfonylamino]benzoyl]oxyacetyl]amino]methyl]benzoate
CID 25042935

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-[4-(sulfamoylmethyl)phenyl]thiophene-2-sulfonamide?
The IUPAC name of 5-chloro-N-[4-(sulfamoylmethyl)phenyl]thiophene-2-sulfonamide (CID 24650329) is 5-chloro-N-[4-(sulfamoylmethyl)phenyl]thiophene-2-sulfonamide.
What is the SMILES notation for 5-chloro-N-[4-(sulfamoylmethyl)phenyl]thiophene-2-sulfonamide?
The canonical SMILES for 5-chloro-N-[4-(sulfamoylmethyl)phenyl]thiophene-2-sulfonamide is NS(=O)(=O)Cc1ccc(NS(=O)(=O)c2ccc(Cl)s2)cc1.
What is the InChIKey of 5-chloro-N-[4-(sulfamoylmethyl)phenyl]thiophene-2-sulfonamide?
The InChIKey is MHNZPLGELVHIAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11ClN2O4S3/c12-10-5-6-11(19-10)21(17,18)14-9-3-1-8(2-4-9)7-20(13,15)16/h1-6,14H,7H2,(H2,13,15,16).
What are the key properties of 5-chloro-N-[4-(sulfamoylmethyl)phenyl]thiophene-2-sulfonamide?
5-chloro-N-[4-(sulfamoylmethyl)phenyl]thiophene-2-sulfonamide has a molecular weight of 366.87 g/mol, XLogP of 1.99, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-[4-(sulfamoylmethyl)phenyl]thiophene-2-sulfonamide is sourced from PubChem (CID 24650329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).