3-(3,4-Dimethylphenyl)sulfonyl-6-methoxychromen-2-one
TL;DR: 3-(3,4-Dimethylphenyl)sulfonyl-6-methoxychromen-2-one (CAS 866013-18-5) is a chemical compound with molecular formula C18H16O5S and molecular weight 344.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(3,4-dimethylphenyl)sulfonyl-6-methoxychromen-2-one
Also Known As: 3-(3,4-dimethylbenzenesulfonyl)-6-methoxy-2H-chromen-2-one, AB01319241-02, 3-(3,4-dimethylphenyl)sulfonyl-6-methoxychromen-2-one, 3-[(3,4-dimethylphenyl)sulfonyl]-6-methoxy-2H-chromen-2-one, F1601-0352
| Molecular Formula | C18H16O5S |
|---|---|
| Molecular Weight | 344.07 g/mol |
| LogP | 3.25124 |
| Topological Polar Surface Area | 73.58 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 344.07184 |
| Heavy Atoms | 24 |
| Complexity | 1094.0825 |
Chemical Identifiers
| CAS Number | 866013-18-5 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)S(=O)(=O)C2=CC3=C(C=CC(=C3)OC)OC2=O)C |
Product Overview
3-(3,4-Dimethylphenyl)sulfonyl-6-methoxychromen-2-one (CAS 866013-18-5), with molecular formula C18H16O5S and molecular weight 344.07 g/mol. IUPAC: 3-(3,4-dimethylphenyl)sulfonyl-6-methoxychromen-2-one.
Chemical Property Profile of 3-(3,4-Dimethylphenyl)sulfonyl-6-methoxychromen-2-one
Property Insights of 3-(3,4-Dimethylphenyl)sulfonyl-6-methoxychromen-2-one
The XLogP value of 3.25124 indicates that 3-(3,4-Dimethylphenyl)sulfonyl-6-methoxychromen-2-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.58 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(3,4-Dimethylphenyl)sulfonyl-6-methoxychromen-2-one. Following Lipinski's Rule of Five, 3-(3,4-Dimethylphenyl)sulfonyl-6-methoxychromen-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 3-(3,4-Dimethylphenyl)sulfonyl-6-methoxychromen-2-one?
The CAS number of 3-(3,4-Dimethylphenyl)sulfonyl-6-methoxychromen-2-one is 866013-18-5.
What is the molecular formula of 3-(3,4-Dimethylphenyl)sulfonyl-6-methoxychromen-2-one?
The molecular formula of 3-(3,4-Dimethylphenyl)sulfonyl-6-methoxychromen-2-one is C18H16O5S.
What is the molecular weight of 3-(3,4-Dimethylphenyl)sulfonyl-6-methoxychromen-2-one?
The molecular weight of 3-(3,4-Dimethylphenyl)sulfonyl-6-methoxychromen-2-one is 344.07 g/mol.
Where can I buy 3-(3,4-Dimethylphenyl)sulfonyl-6-methoxychromen-2-one?
You can request a quote for 3-(3,4-Dimethylphenyl)sulfonyl-6-methoxychromen-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-(3,4-Dimethylphenyl)sulfonyl-6-methoxychromen-2-one?
Yes, KEHONG BIO provides custom synthesis services for 3-(3,4-Dimethylphenyl)sulfonyl-6-methoxychromen-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.