7J-309S
TL;DR: 7J-309S (CAS 866051-49-2) is a chemical compound with molecular formula C18H21NO3S and molecular weight 331.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,6-dimethyl-3-(3-methylphenyl)sulfonyl-1-(2-methylprop-2-enyl)pyridin-2-one
Also Known As: 7J-309S, 4,6-dimethyl-3-[(3-methylphenyl)sulfonyl]-1-(2-methyl-2-propenyl)-2(1H)-pyridinone, 4,6-dimethyl-3-(3-methylbenzenesulfonyl)-1-(2-methylprop-2-en-1-yl)-1,2-dihydropyridin-2-one, 4,6-dimethyl-3-(3-methylphenyl)sulfonyl-1-(2-methylprop-2-enyl)pyridin-2-one
| Molecular Formula | C18H21NO3S |
|---|---|
| Molecular Weight | 331.12 g/mol |
| LogP | 3.18246 |
| Topological Polar Surface Area | 56.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 331.1242 |
| Heavy Atoms | 23 |
| Complexity | 937.2244 |
Chemical Identifiers
| CAS Number | 866051-49-2 |
|---|---|
| SMILES | CC1=CC(=CC=C1)S(=O)(=O)C2=C(C=C(N(C2=O)CC(=C)C)C)C |
Product Overview
7J-309S (CAS 866051-49-2), with molecular formula C18H21NO3S and molecular weight 331.12 g/mol. IUPAC: 4,6-dimethyl-3-(3-methylphenyl)sulfonyl-1-(2-methylprop-2-enyl)pyridin-2-one.
Chemical Property Profile of 7J-309S
Property Insights of 7J-309S
The XLogP value of 3.18246 indicates that 7J-309S is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.14 Ų, 7J-309S exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7J-309S has 0 hydrogen bond donor(s) and 3 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 7J-309S?
The CAS number of 7J-309S is 866051-49-2.
What is the molecular formula of 7J-309S?
The molecular formula of 7J-309S is C18H21NO3S.
What is the molecular weight of 7J-309S?
The molecular weight of 7J-309S is 331.12 g/mol.
Where can I buy 7J-309S?
You can request a quote for 7J-309S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7J-309S?
Yes, KEHONG BIO provides custom synthesis services for 7J-309S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.