2-(3-Bromophenyl)-2-oxoethyl thiophene-2-carboxylate
TL;DR: 2-(3-Bromophenyl)-2-oxoethyl thiophene-2-carboxylate (CAS 355428-14-7) is a chemical compound with molecular formula C13H9BrO3S and molecular weight 323.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(3-bromophenyl)-2-oxoethyl] thiophene-2-carboxylate
Also Known As: 2-(3-bromophenyl)-2-oxoethyl thiophene-2-carboxylate, [2-(3-bromophenyl)-2-oxoethyl] thiophene-2-carboxylate
| Molecular Formula | C13H9BrO3S |
|---|---|
| Molecular Weight | 323.95 g/mol |
| LogP | 3.5503 |
| Topological Polar Surface Area | 43.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 323.9456 |
| Heavy Atoms | 18 |
| Complexity | 563.3751 |
Chemical Identifiers
| CAS Number | 355428-14-7 |
|---|---|
| SMILES | C1=CC(=CC(=C1)Br)C(=O)COC(=O)C2=CC=CS2 |
Product Overview
2-(3-Bromophenyl)-2-oxoethyl thiophene-2-carboxylate (CAS 355428-14-7), with molecular formula C13H9BrO3S and molecular weight 323.95 g/mol. IUPAC: [2-(3-bromophenyl)-2-oxoethyl] thiophene-2-carboxylate.
Chemical Property Profile of 2-(3-Bromophenyl)-2-oxoethyl thiophene-2-carboxylate
Property Insights of 2-(3-Bromophenyl)-2-oxoethyl thiophene-2-carboxylate
The XLogP value of 3.5503 indicates that 2-(3-Bromophenyl)-2-oxoethyl thiophene-2-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.37 Ų, 2-(3-Bromophenyl)-2-oxoethyl thiophene-2-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(3-Bromophenyl)-2-oxoethyl thiophene-2-carboxylate has 0 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-(3-Bromophenyl)-2-oxoethyl thiophene-2-carboxylate?
The CAS number of 2-(3-Bromophenyl)-2-oxoethyl thiophene-2-carboxylate is 355428-14-7.
What is the molecular formula of 2-(3-Bromophenyl)-2-oxoethyl thiophene-2-carboxylate?
The molecular formula of 2-(3-Bromophenyl)-2-oxoethyl thiophene-2-carboxylate is C13H9BrO3S.
What is the molecular weight of 2-(3-Bromophenyl)-2-oxoethyl thiophene-2-carboxylate?
The molecular weight of 2-(3-Bromophenyl)-2-oxoethyl thiophene-2-carboxylate is 323.95 g/mol.
Where can I buy 2-(3-Bromophenyl)-2-oxoethyl thiophene-2-carboxylate?
You can request a quote for 2-(3-Bromophenyl)-2-oxoethyl thiophene-2-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(3-Bromophenyl)-2-oxoethyl thiophene-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for 2-(3-Bromophenyl)-2-oxoethyl thiophene-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.