![6-[4-(benzenesulfonyl)phenyl]-2-methoxy-6-methyl-2H-pyran-5-one structure](/static/products/818/81830-85-5.png)
6-[4-(benzenesulfonyl)phenyl]-2-methoxy-6-methyl-2H-pyran-5-one
TL;DR: 6-[4-(benzenesulfonyl)phenyl]-2-methoxy-6-methyl-2H-pyran-5-one (CAS 81830-85-5) 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.
6-[4-(benzenesulfonyl)phenyl]-2-methoxy-6-methyl-2H-pyran-5-one
Also Known As: 6-[4-(benzenesulfonyl)phenyl]-2-methoxy-6-methyl-2H-pyran-5-one, 2-[4-(Benzenesulfonyl)phenyl]-6-methoxy-2-methyl-2H-pyran-3(6H)-one
| Molecular Formula | C19H18O5S |
|---|---|
| Molecular Weight | 358.09 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 78.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 358.0875 |
| Heavy Atoms | 25 |
| Complexity | 606.0 |
Chemical Identifiers
| CAS Number | 81830-85-5 |
|---|---|
| SMILES | CC1(C(=O)C=CC(O1)OC)C2=CC=C(C=C2)S(=O)(=O)C3=CC=CC=C3 |
| InChIKey | BSMULYPUCAQMJS-UHFFFAOYSA-N |
Product Overview
6-[4-(benzenesulfonyl)phenyl]-2-methoxy-6-methyl-2H-pyran-5-one (CAS 81830-85-5), with molecular formula C19H18O5S and molecular weight 358.09 g/mol. IUPAC: 6-[4-(benzenesulfonyl)phenyl]-2-methoxy-6-methyl-2H-pyran-5-one.
Chemical Property Profile of 6-[4-(benzenesulfonyl)phenyl]-2-methoxy-6-methyl-2H-pyran-5-one
Property Insights of 6-[4-(benzenesulfonyl)phenyl]-2-methoxy-6-methyl-2H-pyran-5-one
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-[4-(benzenesulfonyl)phenyl]-2-methoxy-6-methyl-2H-pyran-5-one. The TPSA of 78.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-[4-(benzenesulfonyl)phenyl]-2-methoxy-6-methyl-2H-pyran-5-one. Following Lipinski's Rule of Five, 6-[4-(benzenesulfonyl)phenyl]-2-methoxy-6-methyl-2H-pyran-5-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 6-[4-(benzenesulfonyl)phenyl]-2-methoxy-6-methyl-2H-pyran-5-one?
The CAS number of 6-[4-(benzenesulfonyl)phenyl]-2-methoxy-6-methyl-2H-pyran-5-one is 81830-85-5.
What is the molecular formula of 6-[4-(benzenesulfonyl)phenyl]-2-methoxy-6-methyl-2H-pyran-5-one?
The molecular formula of 6-[4-(benzenesulfonyl)phenyl]-2-methoxy-6-methyl-2H-pyran-5-one is C19H18O5S.
What is the molecular weight of 6-[4-(benzenesulfonyl)phenyl]-2-methoxy-6-methyl-2H-pyran-5-one?
The molecular weight of 6-[4-(benzenesulfonyl)phenyl]-2-methoxy-6-methyl-2H-pyran-5-one is 358.09 g/mol.
Where can I buy 6-[4-(benzenesulfonyl)phenyl]-2-methoxy-6-methyl-2H-pyran-5-one?
You can request a quote for 6-[4-(benzenesulfonyl)phenyl]-2-methoxy-6-methyl-2H-pyran-5-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-[4-(benzenesulfonyl)phenyl]-2-methoxy-6-methyl-2H-pyran-5-one?
Yes, KEHONG BIO provides custom synthesis services for 6-[4-(benzenesulfonyl)phenyl]-2-methoxy-6-methyl-2H-pyran-5-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.