AF-399/34897044
TL;DR: AF-399/34897044 (CAS 297147-92-3) is a chemical compound with molecular formula C18H9Cl2F3O6 and molecular weight 447.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[3-(2,4-dichlorophenoxy)-4-oxo-2-(trifluoromethyl)chromen-7-yl]oxyacetic acid
Also Known As: AF-399/34897044, {[3-(2,4-dichlorophenoxy)-4-oxo-2-(trifluoromethyl)-4H-chromen-7-yl]oxy}acetic acid, 2-((3-(2,4-dichlorophenoxy)-4-oxo-2-(trifluoromethyl)-4H-chromen-7-yl)oxy)acetic acid, 2-[3-(2,4-dichlorophenoxy)-4-oxo-2-(trifluoromethyl)chromen-7-yl]oxyacetic acid
| Molecular Formula | C18H9Cl2F3O6 |
|---|---|
| Molecular Weight | 447.97 g/mol |
| LogP | 5.3743 |
| Topological Polar Surface Area | 85.97 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 447.97284 |
| Heavy Atoms | 29 |
| Complexity | 1156.7672 |
Chemical Identifiers
| CAS Number | 297147-92-3 |
|---|---|
| SMILES | C1=CC2=C(C=C1OCC(=O)O)OC(=C(C2=O)OC3=C(C=C(C=C3)Cl)Cl)C(F)(F)F |
Product Overview
AF-399/34897044 (CAS 297147-92-3), with molecular formula C18H9Cl2F3O6 and molecular weight 447.97 g/mol. IUPAC: 2-[3-(2,4-dichlorophenoxy)-4-oxo-2-(trifluoromethyl)chromen-7-yl]oxyacetic acid.
Chemical Property Profile of AF-399/34897044
Property Insights of AF-399/34897044
The XLogP value of 5.3743 indicates that AF-399/34897044 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.97 Ų falls within the moderate polarity range, balancing permeability and solubility for AF-399/34897044. Following Lipinski's Rule of Five, AF-399/34897044 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AF-399/34897044?
The CAS number of AF-399/34897044 is 297147-92-3.
What is the molecular formula of AF-399/34897044?
The molecular formula of AF-399/34897044 is C18H9Cl2F3O6.
What is the molecular weight of AF-399/34897044?
The molecular weight of AF-399/34897044 is 447.97 g/mol.
Where can I buy AF-399/34897044?
You can request a quote for AF-399/34897044 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AF-399/34897044?
Yes, KEHONG BIO provides custom synthesis services for AF-399/34897044 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.