4-methyl-3-[(5-methyl-1,3-thiazol-2-yl)sulfamoyl]thiophene-2-carboxylic acid

C10H10N2O4S3 — CID 102747581

IUPAC4-methyl-3-[(5-methyl-1,3-thiazol-2-yl)sulfamoyl]thiophene-2-carboxylic acid
SMILESCc1cnc(NS(=O)(=O)c2c(C)csc2C(=O)O)s1
InChIInChI=1S/C10H10N2O4S3/c1-5-4-17-7(9(13)14)8(5)19(15,16)12-10-11-3-6(2)18-10/h3-4H,1-2H3,(H,11,12)(H,13,14)
InChIKeyHUUZLVRCJSHRLT-UHFFFAOYSA-N
MW318.40 g/mol
LogP2.32
Rot. Bonds4

About 4-methyl-3-[(5-methyl-1,3-thiazol-2-yl)sulfamoyl]thiophene-2-carboxylic acid

4-methyl-3-[(5-methyl-1,3-thiazol-2-yl)sulfamoyl]thiophene-2-carboxylic acid (PubChem CID 102747581) has the molecular formula C10H10N2O4S3 and a molecular weight of 318.40 g/mol. Its IUPAC name is 4-methyl-3-[(5-methyl-1,3-thiazol-2-yl)sulfamoyl]thiophene-2-carboxylic acid.

Molecular Properties

Compound Name4-methyl-3-[(5-methyl-1,3-thiazol-2-yl)sulfamoyl]thiophene-2-carboxylic acid
PubChem CID102747581
Molecular FormulaC10H10N2O4S3
Molecular Weight318.40 g/mol
Exact Mass317.98
IUPAC Name4-methyl-3-[(5-methyl-1,3-thiazol-2-yl)sulfamoyl]thiophene-2-carboxylic acid
SMILESCc1cnc(NS(=O)(=O)c2c(C)csc2C(=O)O)s1
InChIInChI=1S/C10H10N2O4S3/c1-5-4-17-7(9(13)14)8(5)19(15,16)12-10-11-3-6(2)18-10/h3-4H,1-2H3,(H,11,12)(H,13,14)
InChIKeyHUUZLVRCJSHRLT-UHFFFAOYSA-N
XLogP2.32
TPSA96.36 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.40
LogP ≤ 52.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 4-methyl-3-[(5-methyl-1,3-thiazol-2-yl)sulfamoyl]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-[(5-Methyl-1,3-thiazol-2-yl)sulfamoyl]benzoic acid
CID 6489807
3-[(5-Methyl-1,3-thiazol-2-yl)sulfamoyl]benzoic acid
CID 16788425
5-[(5-Methyl-1,3-thiazol-2-yl)sulfamoyl]thiophene-3-carboxylic acid
CID 29039414
2-[5-[(5-Methyl-1,3-thiazol-2-yl)sulfamoyl]thiophen-2-yl]acetic acid
CID 29545268
3-(1,3-Thiazol-2-ylsulfamoyl)thiophene-2-carboxylic acid
CID 43090759
5-Bromo-4-[(5-methyl-1,3-thiazol-2-yl)sulfamoyl]thiophene-2-carboxylic acid
CID 43173226
3-[(5-Methyl-1,3-thiazol-2-yl)sulfamoyl]thiophene-2-carboxylic acid
CID 43235756
3-Methyl-5-(1,3-thiazol-2-ylsulfamoyl)thiophene-2-carboxylic acid
CID 43314385
3-Methyl-5-[(5-methyl-1,3-thiazol-2-yl)sulfamoyl]thiophene-2-carboxylic acid
CID 43314447
3-[(5-Methyl-1,3-thiazol-2-yl)sulfamoylmethyl]benzoic acid
CID 43362480
4-[(5-Methyl-1,3-thiazol-2-yl)sulfamoylmethyl]benzoic acid
CID 43362481
5-[(5-Bromo-1,3-thiazol-2-yl)sulfamoyl]thiophene-2-carboxylic acid
CID 54907331

Frequently Asked Questions

What is the IUPAC name of 4-methyl-3-[(5-methyl-1,3-thiazol-2-yl)sulfamoyl]thiophene-2-carboxylic acid?
The IUPAC name of 4-methyl-3-[(5-methyl-1,3-thiazol-2-yl)sulfamoyl]thiophene-2-carboxylic acid (CID 102747581) is 4-methyl-3-[(5-methyl-1,3-thiazol-2-yl)sulfamoyl]thiophene-2-carboxylic acid.
What is the SMILES notation for 4-methyl-3-[(5-methyl-1,3-thiazol-2-yl)sulfamoyl]thiophene-2-carboxylic acid?
The canonical SMILES for 4-methyl-3-[(5-methyl-1,3-thiazol-2-yl)sulfamoyl]thiophene-2-carboxylic acid is Cc1cnc(NS(=O)(=O)c2c(C)csc2C(=O)O)s1.
What is the InChIKey of 4-methyl-3-[(5-methyl-1,3-thiazol-2-yl)sulfamoyl]thiophene-2-carboxylic acid?
The InChIKey is HUUZLVRCJSHRLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N2O4S3/c1-5-4-17-7(9(13)14)8(5)19(15,16)12-10-11-3-6(2)18-10/h3-4H,1-2H3,(H,11,12)(H,13,14).
What are the key properties of 4-methyl-3-[(5-methyl-1,3-thiazol-2-yl)sulfamoyl]thiophene-2-carboxylic acid?
4-methyl-3-[(5-methyl-1,3-thiazol-2-yl)sulfamoyl]thiophene-2-carboxylic acid has a molecular weight of 318.40 g/mol, XLogP of 2.32, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-3-[(5-methyl-1,3-thiazol-2-yl)sulfamoyl]thiophene-2-carboxylic acid is sourced from PubChem (CID 102747581), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).