7-hydroxy-4-methyl-5-oxothieno[3,2-b]pyridine-6-carboxylic acid

C9H7NO4S — CID 68721405

IUPAC7-hydroxy-4-methyl-5-oxothieno[3,2-b]pyridine-6-carboxylic acid
SMILESCn1c(=O)c(C(=O)O)c(O)c2sccc21
InChIInChI=1S/C9H7NO4S/c1-10-4-2-3-15-7(4)6(11)5(8(10)12)9(13)14/h2-3,11H,1H3,(H,13,14)
InChIKeyWASYCJBSJSKWCK-UHFFFAOYSA-N
MW225.22 g/mol
LogP1.00
Rot. Bonds1

About 7-hydroxy-4-methyl-5-oxothieno[3,2-b]pyridine-6-carboxylic acid

7-hydroxy-4-methyl-5-oxothieno[3,2-b]pyridine-6-carboxylic acid (PubChem CID 68721405) has the molecular formula C9H7NO4S and a molecular weight of 225.22 g/mol. Its IUPAC name is 7-hydroxy-4-methyl-5-oxothieno[3,2-b]pyridine-6-carboxylic acid.

Molecular Properties

Compound Name7-hydroxy-4-methyl-5-oxothieno[3,2-b]pyridine-6-carboxylic acid
PubChem CID68721405
Molecular FormulaC9H7NO4S
Molecular Weight225.22 g/mol
Exact Mass225.01
IUPAC Name7-hydroxy-4-methyl-5-oxothieno[3,2-b]pyridine-6-carboxylic acid
SMILESCn1c(=O)c(C(=O)O)c(O)c2sccc21
InChIInChI=1S/C9H7NO4S/c1-10-4-2-3-15-7(4)6(11)5(8(10)12)9(13)14/h2-3,11H,1H3,(H,13,14)
InChIKeyWASYCJBSJSKWCK-UHFFFAOYSA-N
XLogP1.00
TPSA79.53 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.22
LogP ≤ 51.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 7-hydroxy-4-methyl-5-oxothieno[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
ethyl 7-hydroxy-4-methyl-5-oxo-4H,5H-thieno[3,2-b]pyridine-6-carboxylate
CID 57744891
Methyl 5,7-dihydroxythieno[3,2-b]pyridine-6-carboxylate
CID 54734580
4-(3-Fluoro-benzyl)-7-hydroxy-5-oxo-4,5-dihydro-thieno[3,2-b]pyridine-6-carboxylic acid
CID 69316170
5-oxo-4H-thieno[3,2-b]pyridine-6-carboxylic acid
CID 23130748
Ethyl 5,7-dihydroxythieno[3,2-b]pyridine-6-carboxylate
CID 54710119
Ethyl 4-butyl-7-hydroxy-5-oxothieno[3,2-b]pyridine-6-carboxylate
CID 54712467
N-tert-butyl-7-hydroxy-5-oxo-4H-thieno[3,2-b]pyridine-6-carboxamide
CID 54729680
7-Hydroxy-5-oxo-4,5-dihydrothieno[3,2-b]pyridine-6-carboxylic acid
CID 54735409
2-[(7-hydroxy-5-oxo-4H-thieno[3,2-b]pyridine-6-carbonyl)amino]acetic acid
CID 54741195
4-Butyl-7-hydroxy-5-oxothieno[3,2-b]pyridine-6-carboxylic acid
CID 57234426
4-(7-Hydroxy-4-methyl-5-oxothieno[3,2-b]pyridin-6-yl)-4-oxobutanoic acid
CID 57744888

Frequently Asked Questions

What is the IUPAC name of 7-hydroxy-4-methyl-5-oxothieno[3,2-b]pyridine-6-carboxylic acid?
The IUPAC name of 7-hydroxy-4-methyl-5-oxothieno[3,2-b]pyridine-6-carboxylic acid (CID 68721405) is 7-hydroxy-4-methyl-5-oxothieno[3,2-b]pyridine-6-carboxylic acid.
What is the SMILES notation for 7-hydroxy-4-methyl-5-oxothieno[3,2-b]pyridine-6-carboxylic acid?
The canonical SMILES for 7-hydroxy-4-methyl-5-oxothieno[3,2-b]pyridine-6-carboxylic acid is Cn1c(=O)c(C(=O)O)c(O)c2sccc21.
What is the InChIKey of 7-hydroxy-4-methyl-5-oxothieno[3,2-b]pyridine-6-carboxylic acid?
The InChIKey is WASYCJBSJSKWCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7NO4S/c1-10-4-2-3-15-7(4)6(11)5(8(10)12)9(13)14/h2-3,11H,1H3,(H,13,14).
What are the key properties of 7-hydroxy-4-methyl-5-oxothieno[3,2-b]pyridine-6-carboxylic acid?
7-hydroxy-4-methyl-5-oxothieno[3,2-b]pyridine-6-carboxylic acid has a molecular weight of 225.22 g/mol, XLogP of 1.00, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-hydroxy-4-methyl-5-oxothieno[3,2-b]pyridine-6-carboxylic acid is sourced from PubChem (CID 68721405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).