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3-Methylthieno[2,3-b]thiophene-2-carboxylic acid
TL;DR: 3-Methylthieno[2,3-b]thiophene-2-carboxylic acid (CAS 31490-65-0) is a chemical compound with molecular formula C8H6O2S2 and molecular weight 197.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methylthieno[2,3-b]thiophene-5-carboxylic acid
Also Known As: 3-methylthieno[2,3-b]thiophene-2-carboxylic acid, 3-methylthieno-[2,3-b]thiophene-2-carboxylic acid
| Molecular Formula | C8H6O2S2 |
|---|---|
| Molecular Weight | 197.98 g/mol |
| LogP | 2.96942 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 197.98093 |
| Heavy Atoms | 12 |
| Complexity | 438.7833 |
Chemical Identifiers
| CAS Number | 31490-65-0 |
|---|---|
| SMILES | CC1=C(SC2=C1C=CS2)C(=O)O |
Product Overview
3-Methylthieno[2,3-b]thiophene-2-carboxylic acid (CAS 31490-65-0), with molecular formula C8H6O2S2 and molecular weight 197.98 g/mol. IUPAC: 4-methylthieno[2,3-b]thiophene-5-carboxylic acid.
Chemical Property Profile of 3-Methylthieno[2,3-b]thiophene-2-carboxylic acid
Property Insights of 3-Methylthieno[2,3-b]thiophene-2-carboxylic acid
The XLogP value of 2.96942 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Methylthieno[2,3-b]thiophene-2-carboxylic acid. With a topological polar surface area (TPSA) of 37.3 Ų, 3-Methylthieno[2,3-b]thiophene-2-carboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Methylthieno[2,3-b]thiophene-2-carboxylic acid has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-Methylthieno[2,3-b]thiophene-2-carboxylic acid?
The CAS number of 3-Methylthieno[2,3-b]thiophene-2-carboxylic acid is 31490-65-0.
What is the molecular formula of 3-Methylthieno[2,3-b]thiophene-2-carboxylic acid?
The molecular formula of 3-Methylthieno[2,3-b]thiophene-2-carboxylic acid is C8H6O2S2.
What is the molecular weight of 3-Methylthieno[2,3-b]thiophene-2-carboxylic acid?
The molecular weight of 3-Methylthieno[2,3-b]thiophene-2-carboxylic acid is 197.98 g/mol.
Where can I buy 3-Methylthieno[2,3-b]thiophene-2-carboxylic acid?
You can request a quote for 3-Methylthieno[2,3-b]thiophene-2-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Methylthieno[2,3-b]thiophene-2-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-Methylthieno[2,3-b]thiophene-2-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.