4-(2-Thienylmethyl)-3-thiophenecarboxylic acid
TL;DR: 4-(2-Thienylmethyl)-3-thiophenecarboxylic acid (CAS 3217-93-4) is a chemical compound with molecular formula C10H8O2S2 and molecular weight 224.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(thiophen-2-ylmethyl)thiophene-3-carboxylic acid
Also Known As: 4-(2-Thienylmethyl)-3-thiophenecarboxylic acid, NCIStruc1_000898, NCIStruc2_000932, 4-(thiophen-2-ylmethyl)thiophene-3-carboxylic acid, NCI60_001030
| Molecular Formula | C10H8O2S2 |
|---|---|
| Molecular Weight | 224.00 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 93.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 223.99657 |
| Heavy Atoms | 14 |
| Complexity | 220.0 |
Chemical Identifiers
| CAS Number | 3217-93-4 |
|---|---|
| SMILES | C1=CSC(=C1)CC2=CSC=C2C(=O)O |
| InChIKey | JZHLOTURPOOTRC-UHFFFAOYSA-N |
Product Overview
4-(2-Thienylmethyl)-3-thiophenecarboxylic acid (CAS 3217-93-4), with molecular formula C10H8O2S2 and molecular weight 224.00 g/mol. IUPAC: 4-(thiophen-2-ylmethyl)thiophene-3-carboxylic acid.
Chemical Property Profile of 4-(2-Thienylmethyl)-3-thiophenecarboxylic acid
Property Insights of 4-(2-Thienylmethyl)-3-thiophenecarboxylic acid
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(2-Thienylmethyl)-3-thiophenecarboxylic acid. The TPSA of 93.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(2-Thienylmethyl)-3-thiophenecarboxylic acid. Following Lipinski's Rule of Five, 4-(2-Thienylmethyl)-3-thiophenecarboxylic acid has 1 hydrogen bond donor(s) and 4 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 4-(2-Thienylmethyl)-3-thiophenecarboxylic acid?
The CAS number of 4-(2-Thienylmethyl)-3-thiophenecarboxylic acid is 3217-93-4.
What is the molecular formula of 4-(2-Thienylmethyl)-3-thiophenecarboxylic acid?
The molecular formula of 4-(2-Thienylmethyl)-3-thiophenecarboxylic acid is C10H8O2S2.
What is the molecular weight of 4-(2-Thienylmethyl)-3-thiophenecarboxylic acid?
The molecular weight of 4-(2-Thienylmethyl)-3-thiophenecarboxylic acid is 224.00 g/mol.
Where can I buy 4-(2-Thienylmethyl)-3-thiophenecarboxylic acid?
You can request a quote for 4-(2-Thienylmethyl)-3-thiophenecarboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(2-Thienylmethyl)-3-thiophenecarboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-(2-Thienylmethyl)-3-thiophenecarboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.