6-[(3-bromothiophen-2-yl)sulfonylamino]pyridine-2-carboxylic acid

C10H7BrN2O4S2 — CID 63643093

IUPAC6-[(3-bromothiophen-2-yl)sulfonylamino]pyridine-2-carboxylic acid
SMILESO=C(O)c1cccc(NS(=O)(=O)c2sccc2Br)n1
InChIInChI=1S/C10H7BrN2O4S2/c11-6-4-5-18-10(6)19(16,17)13-8-3-1-2-7(12-8)9(14)15/h1-5H,(H,12,13)(H,14,15)
InChIKeyADQUAYISMSKWOH-UHFFFAOYSA-N
MW363.21 g/mol
LogP2.40
Rot. Bonds4

About 6-[(3-bromothiophen-2-yl)sulfonylamino]pyridine-2-carboxylic acid

6-[(3-bromothiophen-2-yl)sulfonylamino]pyridine-2-carboxylic acid (PubChem CID 63643093) has the molecular formula C10H7BrN2O4S2 and a molecular weight of 363.21 g/mol. Its IUPAC name is 6-[(3-bromothiophen-2-yl)sulfonylamino]pyridine-2-carboxylic acid.

Molecular Properties

Compound Name6-[(3-bromothiophen-2-yl)sulfonylamino]pyridine-2-carboxylic acid
PubChem CID63643093
Molecular FormulaC10H7BrN2O4S2
Molecular Weight363.21 g/mol
Exact Mass361.90
IUPAC Name6-[(3-bromothiophen-2-yl)sulfonylamino]pyridine-2-carboxylic acid
SMILESO=C(O)c1cccc(NS(=O)(=O)c2sccc2Br)n1
InChIInChI=1S/C10H7BrN2O4S2/c11-6-4-5-18-10(6)19(16,17)13-8-3-1-2-7(12-8)9(14)15/h1-5H,(H,12,13)(H,14,15)
InChIKeyADQUAYISMSKWOH-UHFFFAOYSA-N
XLogP2.40
TPSA96.36 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.21
LogP ≤ 52.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 6-[(3-bromothiophen-2-yl)sulfonylamino]pyridine-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

6-(benzenesulfonamido)pyridine-2-carboxylic acid
CID 5263740
2-[2-[(3-bromothiophen-2-yl)sulfonylamino]phenyl]acetic acid
CID 62536493
6-[(5-methylthiophen-2-yl)sulfonylamino]pyridine-2-carboxylic acid
CID 5263723
3-bromo-N-(5-methyl-1H-pyrazol-3-yl)thiophene-2-sulfonamide
CID 55259447
3,5-dibromo-2-[(3-bromothiophen-2-yl)sulfonylamino]benzoic acid
CID 63408850
5-[(3-bromothiophen-2-yl)sulfonylamino]-3-methyl-1,2-thiazole-4-carboxylic acid
CID 61458183
3-bromo-N-(3-hydroxy-2-methylphenyl)thiophene-2-sulfonamide
CID 64793855
6-[(3-methylphenyl)sulfonylamino]pyridine-2-carboxylic acid
CID 5263728
5-[(3-bromothiophen-2-yl)sulfonylamino]-2-chlorobenzoic acid
CID 61458150
3-bromo-N-(4,6-dimethylpyrimidin-2-yl)thiophene-2-sulfonamide
CID 54951923
2-[(3-bromothiophen-2-yl)sulfonylamino]-5-fluorobenzoic acid
CID 61061552
3-bromo-N-[3-(sulfamoylamino)phenyl]thiophene-2-sulfonamide
CID 61062460

Frequently Asked Questions

What is the IUPAC name of 6-[(3-bromothiophen-2-yl)sulfonylamino]pyridine-2-carboxylic acid?
The IUPAC name of 6-[(3-bromothiophen-2-yl)sulfonylamino]pyridine-2-carboxylic acid (CID 63643093) is 6-[(3-bromothiophen-2-yl)sulfonylamino]pyridine-2-carboxylic acid.
What is the SMILES notation for 6-[(3-bromothiophen-2-yl)sulfonylamino]pyridine-2-carboxylic acid?
The canonical SMILES for 6-[(3-bromothiophen-2-yl)sulfonylamino]pyridine-2-carboxylic acid is O=C(O)c1cccc(NS(=O)(=O)c2sccc2Br)n1.
What is the InChIKey of 6-[(3-bromothiophen-2-yl)sulfonylamino]pyridine-2-carboxylic acid?
The InChIKey is ADQUAYISMSKWOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7BrN2O4S2/c11-6-4-5-18-10(6)19(16,17)13-8-3-1-2-7(12-8)9(14)15/h1-5H,(H,12,13)(H,14,15).
What are the key properties of 6-[(3-bromothiophen-2-yl)sulfonylamino]pyridine-2-carboxylic acid?
6-[(3-bromothiophen-2-yl)sulfonylamino]pyridine-2-carboxylic acid has a molecular weight of 363.21 g/mol, XLogP of 2.40, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(3-bromothiophen-2-yl)sulfonylamino]pyridine-2-carboxylic acid is sourced from PubChem (CID 63643093), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).