AF-399/42316400
TL;DR: AF-399/42316400 (CAS 637753-71-0) is a chemical compound with molecular formula C23H23NO5 and molecular weight 393.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2,3-dihydro-1,4-benzodioxin-6-yl)-7-hydroxy-8-(piperidin-1-ylmethyl)chromen-4-one
Also Known As: AF-399/42316400, 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-7-hydroxy-8-(piperidin-1-ylmethyl)-4H-chromen-4-one, F3385-0123, 3-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-7-hydroxy-8-(piperidin-1-ylmethyl)-4H-chromen-4-one, 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-7-hydroxy-8-(piperidin-1-ylmethyl)chromen-4-one
| Molecular Formula | C23H23NO5 |
|---|---|
| Molecular Weight | 393.16 g/mol |
| LogP | 3.9227 |
| Topological Polar Surface Area | 72.14 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 393.15762 |
| Heavy Atoms | 29 |
| Complexity | 1114.1866 |
Chemical Identifiers
| CAS Number | 637753-71-0 |
|---|---|
| SMILES | C1CCN(CC1)CC2=C(C=CC3=C2OC=C(C3=O)C4=CC5=C(C=C4)OCCO5)O |
Product Overview
AF-399/42316400 (CAS 637753-71-0), with molecular formula C23H23NO5 and molecular weight 393.16 g/mol. IUPAC: 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-7-hydroxy-8-(piperidin-1-ylmethyl)chromen-4-one.
Chemical Property Profile of AF-399/42316400
Property Insights of AF-399/42316400
The XLogP value of 3.9227 indicates that AF-399/42316400 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.14 Ų falls within the moderate polarity range, balancing permeability and solubility for AF-399/42316400. Following Lipinski's Rule of Five, AF-399/42316400 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 AF-399/42316400?
The CAS number of AF-399/42316400 is 637753-71-0.
What is the molecular formula of AF-399/42316400?
The molecular formula of AF-399/42316400 is C23H23NO5.
What is the molecular weight of AF-399/42316400?
The molecular weight of AF-399/42316400 is 393.16 g/mol.
Where can I buy AF-399/42316400?
You can request a quote for AF-399/42316400 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AF-399/42316400?
Yes, KEHONG BIO provides custom synthesis services for AF-399/42316400 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.