A2681/0114275
TL;DR: A2681/0114275 (CAS 353468-20-9) is a chemical compound with molecular formula C15H14BrNO5S and molecular weight 398.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 5-acetyl-2-[(5-bromofuran-2-carbonyl)amino]-4-methylthiophene-3-carboxylate
Also Known As: A2681/0114275, ethyl 5-acetyl-2-[(5-bromofuran-2-carbonyl)amino]-4-methylthiophene-3-carboxylate, ethyl 5-acetyl-2-(5-bromofuran-2-amido)-4-methylthiophene-3-carboxylate, ethyl 5-acetyl-2-[(5-bromo-2-furoyl)amino]-4-methyl-3-thiophenecarboxylate, ethyl 5-acetyl-2-[(5-bromo(2-furyl))carbonylamino]-4-methylthiophene-3-carboxy late
| Molecular Formula | C15H14BrNO5S |
|---|---|
| Molecular Weight | 398.98 g/mol |
| LogP | 4.04362 |
| Topological Polar Surface Area | 85.61 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 398.9776 |
| Heavy Atoms | 23 |
| Complexity | 776.92444 |
Chemical Identifiers
| CAS Number | 353468-20-9 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC(=C1C)C(=O)C)NC(=O)C2=CC=C(O2)Br |
Product Overview
A2681/0114275 (CAS 353468-20-9), with molecular formula C15H14BrNO5S and molecular weight 398.98 g/mol. IUPAC: ethyl 5-acetyl-2-[(5-bromofuran-2-carbonyl)amino]-4-methylthiophene-3-carboxylate.
Chemical Property Profile of A2681/0114275
Property Insights of A2681/0114275
The XLogP value of 4.04362 indicates that A2681/0114275 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.61 Ų falls within the moderate polarity range, balancing permeability and solubility for A2681/0114275. Following Lipinski's Rule of Five, A2681/0114275 has 1 hydrogen bond donor(s) and 6 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 A2681/0114275?
The CAS number of A2681/0114275 is 353468-20-9.
What is the molecular formula of A2681/0114275?
The molecular formula of A2681/0114275 is C15H14BrNO5S.
What is the molecular weight of A2681/0114275?
The molecular weight of A2681/0114275 is 398.98 g/mol.
Where can I buy A2681/0114275?
You can request a quote for A2681/0114275 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A2681/0114275?
Yes, KEHONG BIO provides custom synthesis services for A2681/0114275 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.