![2-{[(4-Bromophenyl)carbonyl]amino}-5-methylthiophene-3-carboxylic acid structure](/static/products/380/380644-12-2.png)
2-{[(4-Bromophenyl)carbonyl]amino}-5-methylthiophene-3-carboxylic acid
TL;DR: 2-{[(4-Bromophenyl)carbonyl]amino}-5-methylthiophene-3-carboxylic acid (CAS 380644-12-2) is a chemical compound with molecular formula C13H10BrNO3S and molecular weight 338.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4-bromobenzoyl)amino]-5-methylthiophene-3-carboxylic acid
Also Known As: AE-848/12530086, 2-[(4-bromobenzoyl)amino]-5-methylthiophene-3-carboxylic acid, 2-[(4-bromobenzoyl)amino]-5-methyl-3-thiophenecarboxylic acid, 2-(4-BROMOBENZAMIDO)-5-METHYLTHIOPHENE-3-CARBOXYLIC ACID, 2-[(4-bromobenzoyl)amino]-5-methyl-thiophene-3-carboxylic Acid
| Molecular Formula | C13H10BrNO3S |
|---|---|
| Molecular Weight | 338.96 g/mol |
| LogP | 3.76952 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 338.95648 |
| Heavy Atoms | 19 |
| Complexity | 633.83795 |
Chemical Identifiers
| CAS Number | 380644-12-2 |
|---|---|
| SMILES | CC1=CC(=C(S1)NC(=O)C2=CC=C(C=C2)Br)C(=O)O |
Product Overview
2-{[(4-Bromophenyl)carbonyl]amino}-5-methylthiophene-3-carboxylic acid (CAS 380644-12-2), with molecular formula C13H10BrNO3S and molecular weight 338.96 g/mol. IUPAC: 2-[(4-bromobenzoyl)amino]-5-methylthiophene-3-carboxylic acid.
Chemical Property Profile of 2-{[(4-Bromophenyl)carbonyl]amino}-5-methylthiophene-3-carboxylic acid
Property Insights of 2-{[(4-Bromophenyl)carbonyl]amino}-5-methylthiophene-3-carboxylic acid
The XLogP value of 3.76952 indicates that 2-{[(4-Bromophenyl)carbonyl]amino}-5-methylthiophene-3-carboxylic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-{[(4-Bromophenyl)carbonyl]amino}-5-methylthiophene-3-carboxylic acid. Following Lipinski's Rule of Five, 2-{[(4-Bromophenyl)carbonyl]amino}-5-methylthiophene-3-carboxylic acid has 2 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 2-{[(4-Bromophenyl)carbonyl]amino}-5-methylthiophene-3-carboxylic acid?
The CAS number of 2-{[(4-Bromophenyl)carbonyl]amino}-5-methylthiophene-3-carboxylic acid is 380644-12-2.
What is the molecular formula of 2-{[(4-Bromophenyl)carbonyl]amino}-5-methylthiophene-3-carboxylic acid?
The molecular formula of 2-{[(4-Bromophenyl)carbonyl]amino}-5-methylthiophene-3-carboxylic acid is C13H10BrNO3S.
What is the molecular weight of 2-{[(4-Bromophenyl)carbonyl]amino}-5-methylthiophene-3-carboxylic acid?
The molecular weight of 2-{[(4-Bromophenyl)carbonyl]amino}-5-methylthiophene-3-carboxylic acid is 338.96 g/mol.
Where can I buy 2-{[(4-Bromophenyl)carbonyl]amino}-5-methylthiophene-3-carboxylic acid?
You can request a quote for 2-{[(4-Bromophenyl)carbonyl]amino}-5-methylthiophene-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-{[(4-Bromophenyl)carbonyl]amino}-5-methylthiophene-3-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-{[(4-Bromophenyl)carbonyl]amino}-5-methylthiophene-3-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.