AF-399/40713185
TL;DR: AF-399/40713185 (CAS 384797-51-7) is a chemical compound with molecular formula C27H25F3N2O4 and molecular weight 498.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-[(4-ethylpiperazin-1-yl)methyl]-7-hydroxy-3-naphthalen-2-yloxy-2-(trifluoromethyl)chromen-4-one
Also Known As: AF-399/40713185, 8-[(4-ethyl-1-piperazinyl)methyl]-7-hydroxy-3-(2-naphthyloxy)-2-(trifluoromethyl)-4H-chromen-4-one, 8-[(4-ethylpiperazin-1-yl)methyl]-7-hydroxy-3-naphthalen-2-yloxy-2-(trifluoromethyl)chromen-4-one, 8-[(4-ethylpiperazin-1-ium-1-yl)methyl]-3-naphthalen-2-yloxy-4-oxo-2-(trifluoromethyl)chromen-7-olate, 8-((4-ethylpiperazin-1-yl)methyl)-7-hydroxy-3-(naphthalen-2-yloxy)-2-(trifluoromethyl)-4H-chromen-4-one
| Molecular Formula | C27H25F3N2O4 |
|---|---|
| Molecular Weight | 498.18 g/mol |
| LogP | 5.6004 |
| Topological Polar Surface Area | 66.15 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 498.17664 |
| Heavy Atoms | 36 |
| Complexity | 1474.1285 |
Chemical Identifiers
| CAS Number | 384797-51-7 |
|---|---|
| SMILES | CCN1CCN(CC1)CC2=C(C=CC3=C2OC(=C(C3=O)OC4=CC5=CC=CC=C5C=C4)C(F)(F)F)O |
Product Overview
AF-399/40713185 (CAS 384797-51-7), with molecular formula C27H25F3N2O4 and molecular weight 498.18 g/mol. IUPAC: 8-[(4-ethylpiperazin-1-yl)methyl]-7-hydroxy-3-naphthalen-2-yloxy-2-(trifluoromethyl)chromen-4-one.
Chemical Property Profile of AF-399/40713185
Property Insights of AF-399/40713185
The XLogP value of 5.6004 indicates that AF-399/40713185 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.15 Ų falls within the moderate polarity range, balancing permeability and solubility for AF-399/40713185. Following Lipinski's Rule of Five, AF-399/40713185 has 1 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-399/40713185?
The CAS number of AF-399/40713185 is 384797-51-7.
What is the molecular formula of AF-399/40713185?
The molecular formula of AF-399/40713185 is C27H25F3N2O4.
What is the molecular weight of AF-399/40713185?
The molecular weight of AF-399/40713185 is 498.18 g/mol.
Where can I buy AF-399/40713185?
You can request a quote for AF-399/40713185 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AF-399/40713185?
Yes, KEHONG BIO provides custom synthesis services for AF-399/40713185 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.