7-hydroxy-5-oxo-4H-thieno[3,2-b]pyridine-6-carboxylic acid

C8H5NO4S — CID 54735409

IUPAC7-hydroxy-5-oxo-4H-thieno[3,2-b]pyridine-6-carboxylic acid
SMILESO=C(O)c1c(O)c2sccc2[nH]c1=O
InChIInChI=1S/C8H5NO4S/c10-5-4(8(12)13)7(11)9-3-1-2-14-6(3)5/h1-2H,(H,12,13)(H2,9,10,11)
InChIKeyJPDCZQIFCPULTN-UHFFFAOYSA-N
MW211.20 g/mol
LogP0.99
Rot. Bonds1

About 7-hydroxy-5-oxo-4H-thieno[3,2-b]pyridine-6-carboxylic acid

7-hydroxy-5-oxo-4H-thieno[3,2-b]pyridine-6-carboxylic acid (PubChem CID 54735409) has the molecular formula C8H5NO4S and a molecular weight of 211.20 g/mol. Its IUPAC name is 7-hydroxy-5-oxo-4H-thieno[3,2-b]pyridine-6-carboxylic acid.

Molecular Properties

Compound Name7-hydroxy-5-oxo-4H-thieno[3,2-b]pyridine-6-carboxylic acid
PubChem CID54735409
Molecular FormulaC8H5NO4S
Molecular Weight211.20 g/mol
Exact Mass210.99
IUPAC Name7-hydroxy-5-oxo-4H-thieno[3,2-b]pyridine-6-carboxylic acid
SMILESO=C(O)c1c(O)c2sccc2[nH]c1=O
InChIInChI=1S/C8H5NO4S/c10-5-4(8(12)13)7(11)9-3-1-2-14-6(3)5/h1-2H,(H,12,13)(H2,9,10,11)
InChIKeyJPDCZQIFCPULTN-UHFFFAOYSA-N
XLogP0.99
TPSA90.39 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.20
LogP ≤ 50.99
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 7-hydroxy-5-oxo-4H-thieno[3,2-b]pyridine-6-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

2-(7-Hydroxy-4-methyl-5-oxo-4,5-dihydrothieno[3,2-b]pyridine-6-carboxamido)acetic Acid
CID 54749369
Thieno(3,2-b)pyridine-5,7-diol
CID 54679747
3-Acetamidothiophene-2-carboxylic acid
CID 2807579
ethyl 7-hydroxy-4-methyl-5-oxo-4H,5H-thieno[3,2-b]pyridine-6-carboxylate
CID 57744891
ethyl 7-hydroxy-3-methyl-5-oxo-4H-thieno[3,2-b]pyridine-6-carboxylate
CID 54686579
Methyl 5,7-dihydroxythieno[3,2-b]pyridine-6-carboxylate
CID 54734580
3-[(2,2-Dimethylpropanoyl)amino]-2-thiophenecarboxylic acid
CID 2764039
3-[(2-Fluoro-2-methylpropanoyl)amino]thiophene-2-carboxylic acid
CID 130561847
3-(Butyrylamino)thiophene-2-carboxylic acid
CID 20119749
5-oxo-4H-thieno[3,2-b]pyridine-6-carboxylic acid
CID 23130748
7-Hydroxy-5-oxo-4,5-dihydro-thieno[3,2-b]pyridine-6-carbonitrile
CID 54679170
Ethyl 5,7-dihydroxythieno[3,2-b]pyridine-6-carboxylate
CID 54710119

Frequently Asked Questions

What is the IUPAC name of 7-hydroxy-5-oxo-4H-thieno[3,2-b]pyridine-6-carboxylic acid?
The IUPAC name of 7-hydroxy-5-oxo-4H-thieno[3,2-b]pyridine-6-carboxylic acid (CID 54735409) is 7-hydroxy-5-oxo-4H-thieno[3,2-b]pyridine-6-carboxylic acid.
What is the SMILES notation for 7-hydroxy-5-oxo-4H-thieno[3,2-b]pyridine-6-carboxylic acid?
The canonical SMILES for 7-hydroxy-5-oxo-4H-thieno[3,2-b]pyridine-6-carboxylic acid is O=C(O)c1c(O)c2sccc2[nH]c1=O.
What is the InChIKey of 7-hydroxy-5-oxo-4H-thieno[3,2-b]pyridine-6-carboxylic acid?
The InChIKey is JPDCZQIFCPULTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H5NO4S/c10-5-4(8(12)13)7(11)9-3-1-2-14-6(3)5/h1-2H,(H,12,13)(H2,9,10,11).
What are the key properties of 7-hydroxy-5-oxo-4H-thieno[3,2-b]pyridine-6-carboxylic acid?
7-hydroxy-5-oxo-4H-thieno[3,2-b]pyridine-6-carboxylic acid has a molecular weight of 211.20 g/mol, XLogP of 0.99, 1 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-hydroxy-5-oxo-4H-thieno[3,2-b]pyridine-6-carboxylic acid is sourced from PubChem (CID 54735409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).