3-(4-Fluoro-3-methylphenyl)sulfonyl-6-methylchromen-2-one
TL;DR: 3-(4-Fluoro-3-methylphenyl)sulfonyl-6-methylchromen-2-one (CAS 904450-24-4) is a chemical compound with molecular formula C17H13FO4S and molecular weight 332.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-fluoro-3-methylphenyl)sulfonyl-6-methylchromen-2-one
Also Known As: VU0511461-1, 3-(4-fluoro-3-methylbenzenesulfonyl)-6-methyl-2H-chromen-2-one, AB01294012-01, 3-(4-fluoro-3-methylphenyl)sulfonyl-6-methylchromen-2-one, F3165-1429
| Molecular Formula | C17H13FO4S |
|---|---|
| Molecular Weight | 332.05 g/mol |
| LogP | 3.38174 |
| Topological Polar Surface Area | 64.35 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 332.05185 |
| Heavy Atoms | 23 |
| Complexity | 1081.434 |
Chemical Identifiers
| CAS Number | 904450-24-4 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)OC(=O)C(=C2)S(=O)(=O)C3=CC(=C(C=C3)F)C |
Product Overview
3-(4-Fluoro-3-methylphenyl)sulfonyl-6-methylchromen-2-one (CAS 904450-24-4), with molecular formula C17H13FO4S and molecular weight 332.05 g/mol. IUPAC: 3-(4-fluoro-3-methylphenyl)sulfonyl-6-methylchromen-2-one.
Chemical Property Profile of 3-(4-Fluoro-3-methylphenyl)sulfonyl-6-methylchromen-2-one
Property Insights of 3-(4-Fluoro-3-methylphenyl)sulfonyl-6-methylchromen-2-one
The XLogP value of 3.38174 indicates that 3-(4-Fluoro-3-methylphenyl)sulfonyl-6-methylchromen-2-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.35 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(4-Fluoro-3-methylphenyl)sulfonyl-6-methylchromen-2-one. Following Lipinski's Rule of Five, 3-(4-Fluoro-3-methylphenyl)sulfonyl-6-methylchromen-2-one 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 3-(4-Fluoro-3-methylphenyl)sulfonyl-6-methylchromen-2-one?
The CAS number of 3-(4-Fluoro-3-methylphenyl)sulfonyl-6-methylchromen-2-one is 904450-24-4.
What is the molecular formula of 3-(4-Fluoro-3-methylphenyl)sulfonyl-6-methylchromen-2-one?
The molecular formula of 3-(4-Fluoro-3-methylphenyl)sulfonyl-6-methylchromen-2-one is C17H13FO4S.
What is the molecular weight of 3-(4-Fluoro-3-methylphenyl)sulfonyl-6-methylchromen-2-one?
The molecular weight of 3-(4-Fluoro-3-methylphenyl)sulfonyl-6-methylchromen-2-one is 332.05 g/mol.
Where can I buy 3-(4-Fluoro-3-methylphenyl)sulfonyl-6-methylchromen-2-one?
You can request a quote for 3-(4-Fluoro-3-methylphenyl)sulfonyl-6-methylchromen-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-Fluoro-3-methylphenyl)sulfonyl-6-methylchromen-2-one?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-Fluoro-3-methylphenyl)sulfonyl-6-methylchromen-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.