![6-bromo-3-[(3,4-dimethoxyphenyl)sulfonyl]-2H-chromen-2-one structure](/static/products/866/866347-85-5.png)
6-bromo-3-[(3,4-dimethoxyphenyl)sulfonyl]-2H-chromen-2-one
TL;DR: 6-bromo-3-[(3,4-dimethoxyphenyl)sulfonyl]-2H-chromen-2-one (CAS 866347-85-5) is a chemical compound with molecular formula C17H13BrO6S and molecular weight 423.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-bromo-3-(3,4-dimethoxyphenyl)sulfonylchromen-2-one
Also Known As: ChemDiv2_006797, 6-bromo-3-[(3,4-dimethoxyphenyl)sulfonyl]-2H-chromen-2-one, 6-bromo-3-(3,4-dimethoxybenzenesulfonyl)-2H-chromen-2-one, IDI1_005512, 6-bromo-3-(3,4-dimethoxyphenyl)sulfonylchromen-2-one
| Molecular Formula | C17H13BrO6S |
|---|---|
| Molecular Weight | 423.96 g/mol |
| LogP | 3.4055 |
| Topological Polar Surface Area | 82.81 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 423.9616 |
| Heavy Atoms | 25 |
| Complexity | 1117.6765 |
Chemical Identifiers
| CAS Number | 866347-85-5 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)S(=O)(=O)C2=CC3=C(C=CC(=C3)Br)OC2=O)OC |
Product Overview
6-bromo-3-[(3,4-dimethoxyphenyl)sulfonyl]-2H-chromen-2-one (CAS 866347-85-5), with molecular formula C17H13BrO6S and molecular weight 423.96 g/mol. IUPAC: 6-bromo-3-(3,4-dimethoxyphenyl)sulfonylchromen-2-one.
Chemical Property Profile of 6-bromo-3-[(3,4-dimethoxyphenyl)sulfonyl]-2H-chromen-2-one
Property Insights of 6-bromo-3-[(3,4-dimethoxyphenyl)sulfonyl]-2H-chromen-2-one
The XLogP value of 3.4055 indicates that 6-bromo-3-[(3,4-dimethoxyphenyl)sulfonyl]-2H-chromen-2-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 82.81 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-bromo-3-[(3,4-dimethoxyphenyl)sulfonyl]-2H-chromen-2-one. Following Lipinski's Rule of Five, 6-bromo-3-[(3,4-dimethoxyphenyl)sulfonyl]-2H-chromen-2-one has 0 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 6-bromo-3-[(3,4-dimethoxyphenyl)sulfonyl]-2H-chromen-2-one?
The CAS number of 6-bromo-3-[(3,4-dimethoxyphenyl)sulfonyl]-2H-chromen-2-one is 866347-85-5.
What is the molecular formula of 6-bromo-3-[(3,4-dimethoxyphenyl)sulfonyl]-2H-chromen-2-one?
The molecular formula of 6-bromo-3-[(3,4-dimethoxyphenyl)sulfonyl]-2H-chromen-2-one is C17H13BrO6S.
What is the molecular weight of 6-bromo-3-[(3,4-dimethoxyphenyl)sulfonyl]-2H-chromen-2-one?
The molecular weight of 6-bromo-3-[(3,4-dimethoxyphenyl)sulfonyl]-2H-chromen-2-one is 423.96 g/mol.
Where can I buy 6-bromo-3-[(3,4-dimethoxyphenyl)sulfonyl]-2H-chromen-2-one?
You can request a quote for 6-bromo-3-[(3,4-dimethoxyphenyl)sulfonyl]-2H-chromen-2-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-3-[(3,4-dimethoxyphenyl)sulfonyl]-2H-chromen-2-one?
Yes, KEHONG BIO provides custom synthesis services for 6-bromo-3-[(3,4-dimethoxyphenyl)sulfonyl]-2H-chromen-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.