AF-399/15287139
TL;DR: AF-399/15287139 (CAS 329225-80-1) is a chemical compound with molecular formula C25H25F3O6 and molecular weight 478.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
butyl 2-[3-(3,5-dimethylphenoxy)-4-oxo-2-(trifluoromethyl)chromen-7-yl]oxypropanoate
Also Known As: AF-399/15287139, butyl 2-{[3-(3,5-dimethylphenoxy)-4-oxo-2-(trifluoromethyl)-4H-chromen-7-yl]oxy}propanoate, butyl 2-((3-(3,5-dimethylphenoxy)-4-oxo-2-(trifluoromethyl)-4H-chromen-7-yl)oxy)propanoate, butyl 2-[3-(3,5-dimethylphenoxy)-4-oxo-2-(trifluoromethyl)chromen-7-yl]oxypropanoate, butyl 2-[3-(3,5-dimethylphenoxy)-4-oxo-2-(trifluoromethyl)chromen-7-yloxy]prop anoate
| Molecular Formula | C25H25F3O6 |
|---|---|
| Molecular Weight | 478.16 g/mol |
| LogP | 6.33154 |
| Topological Polar Surface Area | 74.97 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 478.1603 |
| Heavy Atoms | 34 |
| Complexity | 1225.6052 |
Chemical Identifiers
| CAS Number | 329225-80-1 |
|---|---|
| SMILES | CCCCOC(=O)C(C)OC1=CC2=C(C=C1)C(=O)C(=C(O2)C(F)(F)F)OC3=CC(=CC(=C3)C)C |
Product Overview
AF-399/15287139 (CAS 329225-80-1), with molecular formula C25H25F3O6 and molecular weight 478.16 g/mol. IUPAC: butyl 2-[3-(3,5-dimethylphenoxy)-4-oxo-2-(trifluoromethyl)chromen-7-yl]oxypropanoate.
Chemical Property Profile of AF-399/15287139
Property Insights of AF-399/15287139
The XLogP value of 6.33154 indicates that AF-399/15287139 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.97 Ų falls within the moderate polarity range, balancing permeability and solubility for AF-399/15287139. Following Lipinski's Rule of Five, AF-399/15287139 has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AF-399/15287139?
The CAS number of AF-399/15287139 is 329225-80-1.
What is the molecular formula of AF-399/15287139?
The molecular formula of AF-399/15287139 is C25H25F3O6.
What is the molecular weight of AF-399/15287139?
The molecular weight of AF-399/15287139 is 478.16 g/mol.
Where can I buy AF-399/15287139?
You can request a quote for AF-399/15287139 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AF-399/15287139?
Yes, KEHONG BIO provides custom synthesis services for AF-399/15287139 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.