5-[1-(5-chlorothiophen-2-yl)ethylsulfamoyl]thiophene-3-carboxylic acid

C11H10ClNO4S3 — CID 43432380

IUPAC5-[1-(5-chlorothiophen-2-yl)ethylsulfamoyl]thiophene-3-carboxylic acid
SMILESCC(NS(=O)(=O)c1cc(C(=O)O)cs1)c1ccc(Cl)s1
InChIInChI=1S/C11H10ClNO4S3/c1-6(8-2-3-9(12)19-8)13-20(16,17)10-4-7(5-18-10)11(14)15/h2-6,13H,1H3,(H,14,15)
InChIKeyMZEMASPQPBTALM-UHFFFAOYSA-N
MW351.86 g/mol
LogP3.20
Rot. Bonds5

About 5-[1-(5-chlorothiophen-2-yl)ethylsulfamoyl]thiophene-3-carboxylic acid

5-[1-(5-chlorothiophen-2-yl)ethylsulfamoyl]thiophene-3-carboxylic acid (PubChem CID 43432380) has the molecular formula C11H10ClNO4S3 and a molecular weight of 351.86 g/mol. Its IUPAC name is 5-[1-(5-chlorothiophen-2-yl)ethylsulfamoyl]thiophene-3-carboxylic acid.

Molecular Properties

Compound Name5-[1-(5-chlorothiophen-2-yl)ethylsulfamoyl]thiophene-3-carboxylic acid
PubChem CID43432380
Molecular FormulaC11H10ClNO4S3
Molecular Weight351.86 g/mol
Exact Mass350.95
IUPAC Name5-[1-(5-chlorothiophen-2-yl)ethylsulfamoyl]thiophene-3-carboxylic acid
SMILESCC(NS(=O)(=O)c1cc(C(=O)O)cs1)c1ccc(Cl)s1
InChIInChI=1S/C11H10ClNO4S3/c1-6(8-2-3-9(12)19-8)13-20(16,17)10-4-7(5-18-10)11(14)15/h2-6,13H,1H3,(H,14,15)
InChIKeyMZEMASPQPBTALM-UHFFFAOYSA-N
XLogP3.20
TPSA83.47 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.86
LogP ≤ 53.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 5-[1-(5-chlorothiophen-2-yl)ethylsulfamoyl]thiophene-3-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

5-[[(1S)-1-(2-chlorophenyl)ethyl]sulfamoyl]thiophene-3-carboxylic acid
CID 81374909
5-[1-(5-methylfuran-2-yl)ethylsulfamoyl]thiophene-3-carboxylic acid
CID 43229148
5-[[(1S)-1-(furan-2-yl)ethyl]sulfamoyl]thiophene-3-carboxylic acid
CID 81409119
5-[[(1S)-1-(2-methylphenyl)ethyl]sulfamoyl]thiophene-3-carboxylic acid
CID 81354446
5-(2-methylpropylsulfamoyl)thiophene-3-carboxylic acid
CID 29033671
methyl 4-[[(1S)-1-(5-chlorothiophen-2-yl)ethyl]sulfamoyl]benzoate
CID 34154732
5-(1-thiophen-2-ylpropylsulfamoyl)thiophene-3-carboxylic acid
CID 61068619
5-(1-hydroxybutan-2-ylsulfamoyl)thiophene-3-carboxylic acid
CID 43498976
5-(4-methylsulfanylbutan-2-ylsulfamoyl)thiophene-3-carboxylic acid
CID 104654871
N-[1-(5-chlorothiophen-2-yl)ethyl]-4-methyl-5-(methylaminomethyl)thiophene-2-sulfonamide
CID 106003829
3-amino-N-[1-(5-chlorothiophen-2-yl)ethyl]benzenesulfonamide
CID 61469000
5-(dimethylaminosulfamoyl)thiophene-3-carboxylic acid
CID 83005192

Frequently Asked Questions

What is the IUPAC name of 5-[1-(5-chlorothiophen-2-yl)ethylsulfamoyl]thiophene-3-carboxylic acid?
The IUPAC name of 5-[1-(5-chlorothiophen-2-yl)ethylsulfamoyl]thiophene-3-carboxylic acid (CID 43432380) is 5-[1-(5-chlorothiophen-2-yl)ethylsulfamoyl]thiophene-3-carboxylic acid.
What is the SMILES notation for 5-[1-(5-chlorothiophen-2-yl)ethylsulfamoyl]thiophene-3-carboxylic acid?
The canonical SMILES for 5-[1-(5-chlorothiophen-2-yl)ethylsulfamoyl]thiophene-3-carboxylic acid is CC(NS(=O)(=O)c1cc(C(=O)O)cs1)c1ccc(Cl)s1.
What is the InChIKey of 5-[1-(5-chlorothiophen-2-yl)ethylsulfamoyl]thiophene-3-carboxylic acid?
The InChIKey is MZEMASPQPBTALM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10ClNO4S3/c1-6(8-2-3-9(12)19-8)13-20(16,17)10-4-7(5-18-10)11(14)15/h2-6,13H,1H3,(H,14,15).
What are the key properties of 5-[1-(5-chlorothiophen-2-yl)ethylsulfamoyl]thiophene-3-carboxylic acid?
5-[1-(5-chlorothiophen-2-yl)ethylsulfamoyl]thiophene-3-carboxylic acid has a molecular weight of 351.86 g/mol, XLogP of 3.20, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[1-(5-chlorothiophen-2-yl)ethylsulfamoyl]thiophene-3-carboxylic acid is sourced from PubChem (CID 43432380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).