CTK5F4596
TL;DR: CTK5F4596 (CAS 85228-87-1) is a chemical compound with molecular formula C21H28O6 and molecular weight 376.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
10-(4,5-dimethoxy-2-methyl-3,6-dioxocyclohexa-1,4-dien-1-yl)-4,8-dimethyldeca-4,8-dienoic acid
Also Known As: C21-H28-06, T 22083, T-22083, (E,E)-10-(4,5-DIMETHOXY-2-METHYL-3,6-DIOXO-1,4-CYCLOHEXADIEN-1-YL)-4,8-DIMETHYL-4,8-DECADIENOIC ACID
| Molecular Formula | C21H28O6 |
|---|---|
| Molecular Weight | 376.19 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 89.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 10 |
| Exact Mass | 376.1886 |
| Heavy Atoms | 27 |
| Complexity | 734.0 |
Chemical Identifiers
| CAS Number | 85228-87-1 |
|---|---|
| SMILES | CC1=C(C(=O)C(=C(C1=O)OC)OC)CC=C(C)CCC=C(C)CCC(=O)O |
| InChIKey | PZGGRDOEBBMXHC-UHFFFAOYSA-N |
Product Overview
CTK5F4596 (CAS 85228-87-1), with molecular formula C21H28O6 and molecular weight 376.19 g/mol. IUPAC: 10-(4,5-dimethoxy-2-methyl-3,6-dioxocyclohexa-1,4-dien-1-yl)-4,8-dimethyldeca-4,8-dienoic acid.
Chemical Property Profile of CTK5F4596
Property Insights of CTK5F4596
The XLogP value of 4.0 indicates that CTK5F4596 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.9 Ų falls within the moderate polarity range, balancing permeability and solubility for CTK5F4596. Following Lipinski's Rule of Five, CTK5F4596 has 1 hydrogen bond donor(s) and 6 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 CTK5F4596?
The CAS number of CTK5F4596 is 85228-87-1.
What is the molecular formula of CTK5F4596?
The molecular formula of CTK5F4596 is C21H28O6.
What is the molecular weight of CTK5F4596?
The molecular weight of CTK5F4596 is 376.19 g/mol.
Where can I buy CTK5F4596?
You can request a quote for CTK5F4596 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CTK5F4596?
Yes, KEHONG BIO provides custom synthesis services for CTK5F4596 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.