AF-399/36429009
TL;DR: AF-399/36429009 (CAS 342779-72-0) is a chemical compound with molecular formula C30H19F3O10 and molecular weight 596.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-[7-[2-(4-methyl-2-oxochromen-7-yl)oxyacetyl]oxy-4-oxo-2-(trifluoromethyl)chromen-3-yl]oxybenzoate
Also Known As: AF-399/36429009, methyl 4-{[7-({[(4-methyl-2-oxo-2H-chromen-7-yl)oxy]acetyl}oxy)-4-oxo-2-(trifluoromethyl)-4H-chromen-3-yl]oxy}benzoate, methyl 4-[7-[2-(4-methyl-2-oxochromen-7-yl)oxyacetyl]oxy-4-oxo-2-(trifluoromethyl)chromen-3-yl]oxybenzoate, methyl 4-((7-(2-((4-methyl-2-oxo-2H-chromen-7-yl)oxy)acetoxy)-4-oxo-2-(trifluoromethyl)-4H-chromen-3-yl)oxy)benzoate
| Molecular Formula | C30H19F3O10 |
|---|---|
| Molecular Weight | 596.09 g/mol |
| LogP | 5.78992 |
| Topological Polar Surface Area | 131.48 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 7 |
| Exact Mass | 596.093 |
| Heavy Atoms | 43 |
| Complexity | 1989.6172 |
Chemical Identifiers
| CAS Number | 342779-72-0 |
|---|---|
| SMILES | CC1=CC(=O)OC2=C1C=CC(=C2)OCC(=O)OC3=CC4=C(C=C3)C(=O)C(=C(O4)C(F)(F)F)OC5=CC=C(C=C5)C(=O)OC |
Product Overview
AF-399/36429009 (CAS 342779-72-0), with molecular formula C30H19F3O10 and molecular weight 596.09 g/mol. IUPAC: methyl 4-[7-[2-(4-methyl-2-oxochromen-7-yl)oxyacetyl]oxy-4-oxo-2-(trifluoromethyl)chromen-3-yl]oxybenzoate.
Chemical Property Profile of AF-399/36429009
Property Insights of AF-399/36429009
The XLogP value of 5.78992 indicates that AF-399/36429009 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 131.48 Ų falls within the moderate polarity range, balancing permeability and solubility for AF-399/36429009. Following Lipinski's Rule of Five, AF-399/36429009 has 0 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AF-399/36429009?
The CAS number of AF-399/36429009 is 342779-72-0.
What is the molecular formula of AF-399/36429009?
The molecular formula of AF-399/36429009 is C30H19F3O10.
What is the molecular weight of AF-399/36429009?
The molecular weight of AF-399/36429009 is 596.09 g/mol.
Where can I buy AF-399/36429009?
You can request a quote for AF-399/36429009 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AF-399/36429009?
Yes, KEHONG BIO provides custom synthesis services for AF-399/36429009 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.