3-(4-bromophenyl)-4-oxo-4H-chromen-7-yl thiophene-2-carboxylate
TL;DR: 3-(4-bromophenyl)-4-oxo-4H-chromen-7-yl thiophene-2-carboxylate (CAS 610752-80-2) is a chemical compound with molecular formula C20H11BrO4S and molecular weight 425.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-(4-bromophenyl)-4-oxochromen-7-yl] thiophene-2-carboxylate
Also Known As: 3-(4-bromophenyl)-4-oxo-4H-chromen-7-yl thiophene-2-carboxylate, [3-(4-bromophenyl)-4-oxochromen-7-yl] thiophene-2-carboxylate, F3139-1506, 3-(4-bromophenyl)-4-oxochromen-7-yl thiophene-2-carboxylate, [3-(4-bromophenyl)-4-oxo-chromen-7-yl] Thiophene-2-carboxylate
| Molecular Formula | C20H11BrO4S |
|---|---|
| Molecular Weight | 425.96 g/mol |
| LogP | 5.5032 |
| Topological Polar Surface Area | 56.51 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 425.95615 |
| Heavy Atoms | 26 |
| Complexity | 1144.8737 |
Chemical Identifiers
| CAS Number | 610752-80-2 |
|---|---|
| SMILES | C1=CSC(=C1)C(=O)OC2=CC3=C(C=C2)C(=O)C(=CO3)C4=CC=C(C=C4)Br |
Product Overview
3-(4-bromophenyl)-4-oxo-4H-chromen-7-yl thiophene-2-carboxylate (CAS 610752-80-2), with molecular formula C20H11BrO4S and molecular weight 425.96 g/mol. IUPAC: [3-(4-bromophenyl)-4-oxochromen-7-yl] thiophene-2-carboxylate.
Chemical Property Profile of 3-(4-bromophenyl)-4-oxo-4H-chromen-7-yl thiophene-2-carboxylate
Property Insights of 3-(4-bromophenyl)-4-oxo-4H-chromen-7-yl thiophene-2-carboxylate
The XLogP value of 5.5032 indicates that 3-(4-bromophenyl)-4-oxo-4H-chromen-7-yl thiophene-2-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.51 Ų, 3-(4-bromophenyl)-4-oxo-4H-chromen-7-yl thiophene-2-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(4-bromophenyl)-4-oxo-4H-chromen-7-yl thiophene-2-carboxylate has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-(4-bromophenyl)-4-oxo-4H-chromen-7-yl thiophene-2-carboxylate?
The CAS number of 3-(4-bromophenyl)-4-oxo-4H-chromen-7-yl thiophene-2-carboxylate is 610752-80-2.
What is the molecular formula of 3-(4-bromophenyl)-4-oxo-4H-chromen-7-yl thiophene-2-carboxylate?
The molecular formula of 3-(4-bromophenyl)-4-oxo-4H-chromen-7-yl thiophene-2-carboxylate is C20H11BrO4S.
What is the molecular weight of 3-(4-bromophenyl)-4-oxo-4H-chromen-7-yl thiophene-2-carboxylate?
The molecular weight of 3-(4-bromophenyl)-4-oxo-4H-chromen-7-yl thiophene-2-carboxylate is 425.96 g/mol.
Where can I buy 3-(4-bromophenyl)-4-oxo-4H-chromen-7-yl thiophene-2-carboxylate?
You can request a quote for 3-(4-bromophenyl)-4-oxo-4H-chromen-7-yl 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 3-(4-bromophenyl)-4-oxo-4H-chromen-7-yl thiophene-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-bromophenyl)-4-oxo-4H-chromen-7-yl thiophene-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.