4-(4-Methanesulfonyl-phenyl)-5,5-dimethyl-3-phenoxy-5H-furan-2-one
TL;DR: 4-(4-Methanesulfonyl-phenyl)-5,5-dimethyl-3-phenoxy-5H-furan-2-one (CAS 189954-16-3) is a chemical compound with molecular formula C19H18O5S and molecular weight 358.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,5-dimethyl-4-(4-methylsulfonylphenyl)-3-phenoxyfuran-2-one
Also Known As: J1.203.087H, 4-(4-Methanesulfonyl-phenyl)-5,5-dimethyl-3-phenoxy-5H-furan-2-one, 5,5-dimethyl-4-(4-methylsulfonylphenyl)-3-phenoxy-furan-2-one, 5,5-dimethyl-4-(4-methylsulfonylphenyl)-3-phenoxyfuran-2-one, 2(5H)-Furanone, 5,5-dimethyl-4-[4-(methylsulfonyl)phenyl]-3-phenoxy-
| Molecular Formula | C19H18O5S |
|---|---|
| Molecular Weight | 358.09 g/mol |
| LogP | 3.2156 |
| Topological Polar Surface Area | 69.67 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 358.0875 |
| Heavy Atoms | 25 |
| Complexity | 939.0688 |
Chemical Identifiers
| CAS Number | 189954-16-3 |
|---|---|
| SMILES | CC1(C(=C(C(=O)O1)OC2=CC=CC=C2)C3=CC=C(C=C3)S(=O)(=O)C)C |
Product Overview
4-(4-Methanesulfonyl-phenyl)-5,5-dimethyl-3-phenoxy-5H-furan-2-one (CAS 189954-16-3), with molecular formula C19H18O5S and molecular weight 358.09 g/mol. IUPAC: 5,5-dimethyl-4-(4-methylsulfonylphenyl)-3-phenoxyfuran-2-one.
Chemical Property Profile of 4-(4-Methanesulfonyl-phenyl)-5,5-dimethyl-3-phenoxy-5H-furan-2-one
Property Insights of 4-(4-Methanesulfonyl-phenyl)-5,5-dimethyl-3-phenoxy-5H-furan-2-one
The XLogP value of 3.2156 indicates that 4-(4-Methanesulfonyl-phenyl)-5,5-dimethyl-3-phenoxy-5H-furan-2-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.67 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(4-Methanesulfonyl-phenyl)-5,5-dimethyl-3-phenoxy-5H-furan-2-one. Following Lipinski's Rule of Five, 4-(4-Methanesulfonyl-phenyl)-5,5-dimethyl-3-phenoxy-5H-furan-2-one has 0 hydrogen bond donor(s) and 5 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 4-(4-Methanesulfonyl-phenyl)-5,5-dimethyl-3-phenoxy-5H-furan-2-one?
The CAS number of 4-(4-Methanesulfonyl-phenyl)-5,5-dimethyl-3-phenoxy-5H-furan-2-one is 189954-16-3.
What is the molecular formula of 4-(4-Methanesulfonyl-phenyl)-5,5-dimethyl-3-phenoxy-5H-furan-2-one?
The molecular formula of 4-(4-Methanesulfonyl-phenyl)-5,5-dimethyl-3-phenoxy-5H-furan-2-one is C19H18O5S.
What is the molecular weight of 4-(4-Methanesulfonyl-phenyl)-5,5-dimethyl-3-phenoxy-5H-furan-2-one?
The molecular weight of 4-(4-Methanesulfonyl-phenyl)-5,5-dimethyl-3-phenoxy-5H-furan-2-one is 358.09 g/mol.
Where can I buy 4-(4-Methanesulfonyl-phenyl)-5,5-dimethyl-3-phenoxy-5H-furan-2-one?
You can request a quote for 4-(4-Methanesulfonyl-phenyl)-5,5-dimethyl-3-phenoxy-5H-furan-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(4-Methanesulfonyl-phenyl)-5,5-dimethyl-3-phenoxy-5H-furan-2-one?
Yes, KEHONG BIO provides custom synthesis services for 4-(4-Methanesulfonyl-phenyl)-5,5-dimethyl-3-phenoxy-5H-furan-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.