4-(2-thiophen-2-ylethylsulfamoyl)thiophene-2-carboxylic acid

C11H11NO4S3 — CID 61072796

IUPAC4-(2-thiophen-2-ylethylsulfamoyl)thiophene-2-carboxylic acid
SMILESO=C(O)c1cc(S(=O)(=O)NCCc2cccs2)cs1
InChIInChI=1S/C11H11NO4S3/c13-11(14)10-6-9(7-18-10)19(15,16)12-4-3-8-2-1-5-17-8/h1-2,5-7,12H,3-4H2,(H,13,14)
InChIKeyCXSURGHOWQLBPG-UHFFFAOYSA-N
MW317.41 g/mol
LogP2.03
Rot. Bonds6

About 4-(2-thiophen-2-ylethylsulfamoyl)thiophene-2-carboxylic acid

4-(2-thiophen-2-ylethylsulfamoyl)thiophene-2-carboxylic acid (PubChem CID 61072796) has the molecular formula C11H11NO4S3 and a molecular weight of 317.41 g/mol. Its IUPAC name is 4-(2-thiophen-2-ylethylsulfamoyl)thiophene-2-carboxylic acid.

Molecular Properties

Compound Name4-(2-thiophen-2-ylethylsulfamoyl)thiophene-2-carboxylic acid
PubChem CID61072796
Molecular FormulaC11H11NO4S3
Molecular Weight317.41 g/mol
Exact Mass316.99
IUPAC Name4-(2-thiophen-2-ylethylsulfamoyl)thiophene-2-carboxylic acid
SMILESO=C(O)c1cc(S(=O)(=O)NCCc2cccs2)cs1
InChIInChI=1S/C11H11NO4S3/c13-11(14)10-6-9(7-18-10)19(15,16)12-4-3-8-2-1-5-17-8/h1-2,5-7,12H,3-4H2,(H,13,14)
InChIKeyCXSURGHOWQLBPG-UHFFFAOYSA-N
XLogP2.03
TPSA83.47 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.41
LogP ≤ 52.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 4-(2-thiophen-2-ylethylsulfamoyl)thiophene-2-carboxylic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-(3-phenylpropylsulfamoyl)thiophene-2-carboxylic acid
CID 61063461
4-[2-(3-chlorophenyl)ethylsulfamoyl]thiophene-2-carboxylic acid
CID 61073730
4-(2-methylsulfinylethylsulfamoyl)thiophene-2-carboxylic acid
CID 104654649
5-(aminomethyl)-N-(2-thiophen-2-ylethyl)-1H-pyrrole-3-sulfonamide
CID 114132189
4-(pentylsulfamoyl)thiophene-2-carboxylic acid
CID 61072767
4-(3,3,3-trifluoropropylsulfamoyl)thiophene-2-carboxylic acid
CID 63618345
3-bromo-N-(2-thiophen-2-ylethyl)benzenesulfonamide
CID 3793268
5-methyl-4-(2-thiophen-2-ylethylsulfamoyl)furan-2-carboxylic acid
CID 62803418
N-[2-methyl-4-(2-thiophen-2-ylethylsulfamoyl)phenyl]acetamide
CID 58962527
4-(aminomethyl)-N-(2-thiophen-2-ylethyl)benzenesulfonamide
CID 18801910
4-[[(1R)-1-thiophen-2-ylethyl]sulfamoyl]thiophene-2-carboxylic acid
CID 81399028
2-(methylamino)-N-(2-thiophen-2-ylethyl)pyridine-4-sulfonamide
CID 62145049

Frequently Asked Questions

What is the IUPAC name of 4-(2-thiophen-2-ylethylsulfamoyl)thiophene-2-carboxylic acid?
The IUPAC name of 4-(2-thiophen-2-ylethylsulfamoyl)thiophene-2-carboxylic acid (CID 61072796) is 4-(2-thiophen-2-ylethylsulfamoyl)thiophene-2-carboxylic acid.
What is the SMILES notation for 4-(2-thiophen-2-ylethylsulfamoyl)thiophene-2-carboxylic acid?
The canonical SMILES for 4-(2-thiophen-2-ylethylsulfamoyl)thiophene-2-carboxylic acid is O=C(O)c1cc(S(=O)(=O)NCCc2cccs2)cs1.
What is the InChIKey of 4-(2-thiophen-2-ylethylsulfamoyl)thiophene-2-carboxylic acid?
The InChIKey is CXSURGHOWQLBPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11NO4S3/c13-11(14)10-6-9(7-18-10)19(15,16)12-4-3-8-2-1-5-17-8/h1-2,5-7,12H,3-4H2,(H,13,14).
What are the key properties of 4-(2-thiophen-2-ylethylsulfamoyl)thiophene-2-carboxylic acid?
4-(2-thiophen-2-ylethylsulfamoyl)thiophene-2-carboxylic acid has a molecular weight of 317.41 g/mol, XLogP of 2.03, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-thiophen-2-ylethylsulfamoyl)thiophene-2-carboxylic acid is sourced from PubChem (CID 61072796), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).