AO-022/43454789
TL;DR: AO-022/43454789 (CAS 879566-92-4) is a chemical compound with molecular formula C22H13FN4O3 and molecular weight 400.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
13-(4-fluorophenyl)-9-(furan-2-yl)-2-oxa-12,14,15,17-tetrazatetracyclo[8.7.0.03,8.011,15]heptadeca-1(10),3(8),4,6,11,13,16-heptaen-5-ol
Also Known As: AO-022/43454789, 2-(4-fluorophenyl)-12-(furan-2-yl)-12H-chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-9-ol, 2-(4-fluorophenyl)-12-(2-furyl)-12H-chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-9-ol
| Molecular Formula | C22H13FN4O3 |
|---|---|
| Molecular Weight | 400.10 g/mol |
| LogP | 4.5149 |
| Topological Polar Surface Area | 85.68 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 400.09717 |
| Heavy Atoms | 30 |
| Complexity | 1394.4656 |
Chemical Identifiers
| CAS Number | 879566-92-4 |
|---|---|
| SMILES | C1=COC(=C1)C2C3=C(C=C(C=C3)O)OC4=C2C5=NC(=NN5C=N4)C6=CC=C(C=C6)F |
Product Overview
AO-022/43454789 (CAS 879566-92-4), with molecular formula C22H13FN4O3 and molecular weight 400.10 g/mol. IUPAC: 13-(4-fluorophenyl)-9-(furan-2-yl)-2-oxa-12,14,15,17-tetrazatetracyclo[8.7.0.03,8.011,15]heptadeca-1(10),3(8),4,6,11,13,16-heptaen-5-ol.
Chemical Property Profile of AO-022/43454789
Property Insights of AO-022/43454789
The XLogP value of 4.5149 indicates that AO-022/43454789 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.68 Ų falls within the moderate polarity range, balancing permeability and solubility for AO-022/43454789. Following Lipinski's Rule of Five, AO-022/43454789 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 AO-022/43454789?
The CAS number of AO-022/43454789 is 879566-92-4.
What is the molecular formula of AO-022/43454789?
The molecular formula of AO-022/43454789 is C22H13FN4O3.
What is the molecular weight of AO-022/43454789?
The molecular weight of AO-022/43454789 is 400.10 g/mol.
Where can I buy AO-022/43454789?
You can request a quote for AO-022/43454789 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AO-022/43454789?
Yes, KEHONG BIO provides custom synthesis services for AO-022/43454789 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.