J2.808.523K
TL;DR: J2.808.523K (CAS 704872-21-9) is a chemical compound with molecular formula C14H19NO3S and molecular weight 281.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6,7-dimethoxy-3,3-dimethyl-1-methylsulfanyl-2-azaspiro[4.5]deca-1,6,9-trien-8-one
Also Known As: J2.808.523K, AB01334600-02, 6,7-dimethoxy-3,3-dimethyl-1-(methylsulfanyl)-2-azaspiro[4.5]deca-1,6,9-trien-8-one, A3678/0155991, 1-(Methylthio)-3,3-dimethyl-6,7-dimethoxy-2-azaspiro[4.5]deca-1,6,9-triene-8-one
| Molecular Formula | C14H19NO3S |
|---|---|
| Molecular Weight | 281.11 g/mol |
| LogP | 2.5599 |
| Topological Polar Surface Area | 47.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 281.10855 |
| Heavy Atoms | 19 |
| Complexity | 504.82047 |
Chemical Identifiers
| CAS Number | 704872-21-9 |
|---|---|
| SMILES | CC1(CC2(C=CC(=O)C(=C2OC)OC)C(=N1)SC)C |
Product Overview
J2.808.523K (CAS 704872-21-9), with molecular formula C14H19NO3S and molecular weight 281.11 g/mol. IUPAC: 6,7-dimethoxy-3,3-dimethyl-1-methylsulfanyl-2-azaspiro[4.5]deca-1,6,9-trien-8-one.
Chemical Property Profile of J2.808.523K
Property Insights of J2.808.523K
The XLogP value of 2.5599 suggests moderate lipophilicity, balancing water solubility and membrane permeability for J2.808.523K. With a topological polar surface area (TPSA) of 47.89 Ų, J2.808.523K exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, J2.808.523K 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 J2.808.523K?
The CAS number of J2.808.523K is 704872-21-9.
What is the molecular formula of J2.808.523K?
The molecular formula of J2.808.523K is C14H19NO3S.
What is the molecular weight of J2.808.523K?
The molecular weight of J2.808.523K is 281.11 g/mol.
Where can I buy J2.808.523K?
You can request a quote for J2.808.523K directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for J2.808.523K?
Yes, KEHONG BIO provides custom synthesis services for J2.808.523K and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.