6-bromo-2-(thiophen-2-yl)-4H-chromen-4-one
TL;DR: 6-bromo-2-(thiophen-2-yl)-4H-chromen-4-one (CAS 39730-46-6) is a chemical compound with molecular formula C13H7BrO2S and molecular weight 305.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-bromo-2-thiophen-2-ylchromen-4-one
Also Known As: 6-bromo-2-(thiophen-2-yl)-4H-chromen-4-one, 6-bromo-2-thiophen-2-ylchromen-4-one, 6-bromo-2-(2-thienyl)chromen-4-one, 6-Bromo-2-(thiophen-2-yl)chromen-4-one, VU0510078-1
| Molecular Formula | C13H7BrO2S |
|---|---|
| Molecular Weight | 305.94 g/mol |
| LogP | 4.284 |
| Topological Polar Surface Area | 30.21 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 305.935 |
| Heavy Atoms | 17 |
| Complexity | 728.75934 |
Chemical Identifiers
| CAS Number | 39730-46-6 |
|---|---|
| SMILES | C1=CSC(=C1)C2=CC(=O)C3=C(O2)C=CC(=C3)Br |
Product Overview
6-bromo-2-(thiophen-2-yl)-4H-chromen-4-one (CAS 39730-46-6), with molecular formula C13H7BrO2S and molecular weight 305.94 g/mol. IUPAC: 6-bromo-2-thiophen-2-ylchromen-4-one.
Chemical Property Profile of 6-bromo-2-(thiophen-2-yl)-4H-chromen-4-one
Property Insights of 6-bromo-2-(thiophen-2-yl)-4H-chromen-4-one
The XLogP value of 4.284 indicates that 6-bromo-2-(thiophen-2-yl)-4H-chromen-4-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 30.21 Ų, 6-bromo-2-(thiophen-2-yl)-4H-chromen-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-bromo-2-(thiophen-2-yl)-4H-chromen-4-one has 0 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 6-bromo-2-(thiophen-2-yl)-4H-chromen-4-one?
The CAS number of 6-bromo-2-(thiophen-2-yl)-4H-chromen-4-one is 39730-46-6.
What is the molecular formula of 6-bromo-2-(thiophen-2-yl)-4H-chromen-4-one?
The molecular formula of 6-bromo-2-(thiophen-2-yl)-4H-chromen-4-one is C13H7BrO2S.
What is the molecular weight of 6-bromo-2-(thiophen-2-yl)-4H-chromen-4-one?
The molecular weight of 6-bromo-2-(thiophen-2-yl)-4H-chromen-4-one is 305.94 g/mol.
Where can I buy 6-bromo-2-(thiophen-2-yl)-4H-chromen-4-one?
You can request a quote for 6-bromo-2-(thiophen-2-yl)-4H-chromen-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-bromo-2-(thiophen-2-yl)-4H-chromen-4-one?
Yes, KEHONG BIO provides custom synthesis services for 6-bromo-2-(thiophen-2-yl)-4H-chromen-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.