AO-022/43454858
TL;DR: AO-022/43454858 (CAS 879586-45-5) is a chemical compound with molecular formula C26H23N5O2 and molecular weight 437.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
13-benzyl-5,5-dimethyl-9-pyridin-3-yl-2-oxa-12,14,15,17-tetrazatetracyclo[8.7.0.03,8.011,15]heptadeca-1(10),3(8),11,13,16-pentaen-7-one
Also Known As: AO-022/43454858, 2-benzyl-9,9-dimethyl-12-(pyridin-3-yl)-9,10-dihydro-8H-chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-11(12H)-one, 13-Benzyl-5,5-dimethyl-9-pyridin-3-yl-2-oxa-12,14,15,17-tetrazatetracyclo[8.7.0.03,8.011,15]heptadeca-1(10),3(8),11,13,16-pentaen-7-one, 2-benzyl-9,9-dimethyl-12-(3-pyridinyl)-8,9,10,12-tetrahydro-11H-chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-11-one, 2-benzyl-9,9-dimethyl-12-(pyridin-3-yl)-8,9,10,12-tetrahydro-11H-chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-11-one
| Molecular Formula | C26H23N5O2 |
|---|---|
| Molecular Weight | 437.19 g/mol |
| LogP | 4.2776 |
| Topological Polar Surface Area | 82.27 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 437.18518 |
| Heavy Atoms | 33 |
| Complexity | 1406.9137 |
Chemical Identifiers
| CAS Number | 879586-45-5 |
|---|---|
| SMILES | CC1(CC2=C(C(C3=C(O2)N=CN4C3=NC(=N4)CC5=CC=CC=C5)C6=CN=CC=C6)C(=O)C1)C |
Product Overview
AO-022/43454858 (CAS 879586-45-5), with molecular formula C26H23N5O2 and molecular weight 437.19 g/mol. IUPAC: 13-benzyl-5,5-dimethyl-9-pyridin-3-yl-2-oxa-12,14,15,17-tetrazatetracyclo[8.7.0.03,8.011,15]heptadeca-1(10),3(8),11,13,16-pentaen-7-one.
Chemical Property Profile of AO-022/43454858
Property Insights of AO-022/43454858
The XLogP value of 4.2776 indicates that AO-022/43454858 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 82.27 Ų falls within the moderate polarity range, balancing permeability and solubility for AO-022/43454858. Following Lipinski's Rule of Five, AO-022/43454858 has 0 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-022/43454858?
The CAS number of AO-022/43454858 is 879586-45-5.
What is the molecular formula of AO-022/43454858?
The molecular formula of AO-022/43454858 is C26H23N5O2.
What is the molecular weight of AO-022/43454858?
The molecular weight of AO-022/43454858 is 437.19 g/mol.
Where can I buy AO-022/43454858?
You can request a quote for AO-022/43454858 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AO-022/43454858?
Yes, KEHONG BIO provides custom synthesis services for AO-022/43454858 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.