![2-(thiophen-2-ylmethylcarbamoyl)-7-oxabicyclo[2.2.1]hept-5-ene-3-carboxylic acid structure](/static/products/100/1005153-94-5.png)
2-(thiophen-2-ylmethylcarbamoyl)-7-oxabicyclo[2.2.1]hept-5-ene-3-carboxylic acid
TL;DR: 2-(thiophen-2-ylmethylcarbamoyl)-7-oxabicyclo[2.2.1]hept-5-ene-3-carboxylic acid (CAS 1005153-94-5) is a chemical compound with molecular formula C13H13NO4S and molecular weight 279.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(thiophen-2-ylmethylcarbamoyl)-7-oxabicyclo[2.2.1]hept-5-ene-2-carboxylic acid
Also Known As: 2-(thiophen-2-ylmethylcarbamoyl)-7-oxabicyclo[2.2.1]hept-5-ene-3-carboxylic acid, 3-((thiophen-2-ylmethyl)carbamoyl)-7-oxabicyclo[2.2.1]hept-5-ene-2-carboxylic acid, 3-[(thiophen-2-ylmethyl)carbamoyl]-7-oxabicyclo[2.2.1]hept-5-ene-2-carboxylic acid, 3-[N-(2-thienylmethyl)carbamoyl]-7-oxabicyclo[2.2.1]hept-5-ene-2-carboxylic ac id, 6-(thiophen-2-ylmethylcarbamoyl)-7-oxabicyclo[2.2.1]hept-2-ene-5-carboxylic Acid
| Molecular Formula | C13H13NO4S |
|---|---|
| Molecular Weight | 279.06 g/mol |
| LogP | 1.0185 |
| Topological Polar Surface Area | 75.63 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 279.05652 |
| Heavy Atoms | 19 |
| Complexity | 524.7554 |
Chemical Identifiers
| CAS Number | 1005153-94-5 |
|---|---|
| SMILES | C1=CSC(=C1)CNC(=O)C2C3C=CC(C2C(=O)O)O3 |
Product Overview
2-(thiophen-2-ylmethylcarbamoyl)-7-oxabicyclo[2.2.1]hept-5-ene-3-carboxylic acid (CAS 1005153-94-5), with molecular formula C13H13NO4S and molecular weight 279.06 g/mol. IUPAC: 3-(thiophen-2-ylmethylcarbamoyl)-7-oxabicyclo[2.2.1]hept-5-ene-2-carboxylic acid.
Chemical Property Profile of 2-(thiophen-2-ylmethylcarbamoyl)-7-oxabicyclo[2.2.1]hept-5-ene-3-carboxylic acid
Property Insights of 2-(thiophen-2-ylmethylcarbamoyl)-7-oxabicyclo[2.2.1]hept-5-ene-3-carboxylic acid
The XLogP value of 1.0185 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(thiophen-2-ylmethylcarbamoyl)-7-oxabicyclo[2.2.1]hept-5-ene-3-carboxylic acid. The TPSA of 75.63 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(thiophen-2-ylmethylcarbamoyl)-7-oxabicyclo[2.2.1]hept-5-ene-3-carboxylic acid. Following Lipinski's Rule of Five, 2-(thiophen-2-ylmethylcarbamoyl)-7-oxabicyclo[2.2.1]hept-5-ene-3-carboxylic acid has 2 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 2-(thiophen-2-ylmethylcarbamoyl)-7-oxabicyclo[2.2.1]hept-5-ene-3-carboxylic acid?
The CAS number of 2-(thiophen-2-ylmethylcarbamoyl)-7-oxabicyclo[2.2.1]hept-5-ene-3-carboxylic acid is 1005153-94-5.
What is the molecular formula of 2-(thiophen-2-ylmethylcarbamoyl)-7-oxabicyclo[2.2.1]hept-5-ene-3-carboxylic acid?
The molecular formula of 2-(thiophen-2-ylmethylcarbamoyl)-7-oxabicyclo[2.2.1]hept-5-ene-3-carboxylic acid is C13H13NO4S.
What is the molecular weight of 2-(thiophen-2-ylmethylcarbamoyl)-7-oxabicyclo[2.2.1]hept-5-ene-3-carboxylic acid?
The molecular weight of 2-(thiophen-2-ylmethylcarbamoyl)-7-oxabicyclo[2.2.1]hept-5-ene-3-carboxylic acid is 279.06 g/mol.
Where can I buy 2-(thiophen-2-ylmethylcarbamoyl)-7-oxabicyclo[2.2.1]hept-5-ene-3-carboxylic acid?
You can request a quote for 2-(thiophen-2-ylmethylcarbamoyl)-7-oxabicyclo[2.2.1]hept-5-ene-3-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(thiophen-2-ylmethylcarbamoyl)-7-oxabicyclo[2.2.1]hept-5-ene-3-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(thiophen-2-ylmethylcarbamoyl)-7-oxabicyclo[2.2.1]hept-5-ene-3-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.