![3-[(4-bromophenyl)sulfonyl]-6-nitro-2H-chromen-2-one structure](/static/products/865/865656-33-3.png)
3-[(4-bromophenyl)sulfonyl]-6-nitro-2H-chromen-2-one
TL;DR: 3-[(4-bromophenyl)sulfonyl]-6-nitro-2H-chromen-2-one (CAS 865656-33-3) is a chemical compound with molecular formula C15H8BrNO6S and molecular weight 408.93 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-bromophenyl)sulfonyl-6-nitrochromen-2-one
Also Known As: 3-[(4-bromophenyl)sulfonyl]-6-nitro-2H-chromen-2-one, 3-(4-bromophenyl)sulfonyl-6-nitrochromen-2-one, 3-(4-bromobenzenesulfonyl)-6-nitro-2H-chromen-2-one, 3-(4-bromophenyl)sulfonyl-6-nitro-chromen-2-one, 3-((4-bromophenyl)sulfonyl)-6-nitro-2H-chromen-2-one
| Molecular Formula | C15H8BrNO6S |
|---|---|
| Molecular Weight | 408.93 g/mol |
| LogP | 3.2965 |
| Topological Polar Surface Area | 107.49 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 408.92557 |
| Heavy Atoms | 24 |
| Complexity | 1118.9045 |
Chemical Identifiers
| CAS Number | 865656-33-3 |
|---|---|
| SMILES | C1=CC(=CC=C1S(=O)(=O)C2=CC3=C(C=CC(=C3)[N+](=O)[O-])OC2=O)Br |
Product Overview
3-[(4-bromophenyl)sulfonyl]-6-nitro-2H-chromen-2-one (CAS 865656-33-3), with molecular formula C15H8BrNO6S and molecular weight 408.93 g/mol. IUPAC: 3-(4-bromophenyl)sulfonyl-6-nitrochromen-2-one.
Chemical Property Profile of 3-[(4-bromophenyl)sulfonyl]-6-nitro-2H-chromen-2-one
Property Insights of 3-[(4-bromophenyl)sulfonyl]-6-nitro-2H-chromen-2-one
The XLogP value of 3.2965 indicates that 3-[(4-bromophenyl)sulfonyl]-6-nitro-2H-chromen-2-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 107.49 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[(4-bromophenyl)sulfonyl]-6-nitro-2H-chromen-2-one. Following Lipinski's Rule of Five, 3-[(4-bromophenyl)sulfonyl]-6-nitro-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 3-[(4-bromophenyl)sulfonyl]-6-nitro-2H-chromen-2-one?
The CAS number of 3-[(4-bromophenyl)sulfonyl]-6-nitro-2H-chromen-2-one is 865656-33-3.
What is the molecular formula of 3-[(4-bromophenyl)sulfonyl]-6-nitro-2H-chromen-2-one?
The molecular formula of 3-[(4-bromophenyl)sulfonyl]-6-nitro-2H-chromen-2-one is C15H8BrNO6S.
What is the molecular weight of 3-[(4-bromophenyl)sulfonyl]-6-nitro-2H-chromen-2-one?
The molecular weight of 3-[(4-bromophenyl)sulfonyl]-6-nitro-2H-chromen-2-one is 408.93 g/mol.
Where can I buy 3-[(4-bromophenyl)sulfonyl]-6-nitro-2H-chromen-2-one?
You can request a quote for 3-[(4-bromophenyl)sulfonyl]-6-nitro-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 3-[(4-bromophenyl)sulfonyl]-6-nitro-2H-chromen-2-one?
Yes, KEHONG BIO provides custom synthesis services for 3-[(4-bromophenyl)sulfonyl]-6-nitro-2H-chromen-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.