AO-022/43454261
TL;DR: AO-022/43454261 (CAS 839703-30-9) is a chemical compound with molecular formula C23H21N5O and molecular weight 383.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
17-(3-methylphenyl)-13-(2-methylpropyl)-2,9,13,15,17-pentazatetracyclo[8.7.0.03,8.011,16]heptadeca-1,3,5,7,9,11(16),14-heptaen-12-one
Also Known As: AO-022/43454261, 3-isobutyl-11-(m-tolyl)-3H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4(11H)-one, 11-(3-methylphenyl)-3-(2-methylpropyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one, 3-isobutyl-11-(3-methylphenyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
| Molecular Formula | C23H21N5O |
|---|---|
| Molecular Weight | 383.17 g/mol |
| LogP | 4.24802 |
| Topological Polar Surface Area | 65.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 383.17462 |
| Heavy Atoms | 29 |
| Complexity | 1444.9663 |
Chemical Identifiers
| CAS Number | 839703-30-9 |
|---|---|
| SMILES | CC1=CC(=CC=C1)N2C3=C(C4=NC5=CC=CC=C5N=C42)C(=O)N(C=N3)CC(C)C |
Product Overview
AO-022/43454261 (CAS 839703-30-9), with molecular formula C23H21N5O and molecular weight 383.17 g/mol. IUPAC: 17-(3-methylphenyl)-13-(2-methylpropyl)-2,9,13,15,17-pentazatetracyclo[8.7.0.03,8.011,16]heptadeca-1,3,5,7,9,11(16),14-heptaen-12-one.
Chemical Property Profile of AO-022/43454261
Property Insights of AO-022/43454261
The XLogP value of 4.24802 indicates that AO-022/43454261 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.6 Ų falls within the moderate polarity range, balancing permeability and solubility for AO-022/43454261. Following Lipinski's Rule of Five, AO-022/43454261 has 0 hydrogen bond donor(s) and 4 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-022/43454261?
The CAS number of AO-022/43454261 is 839703-30-9.
What is the molecular formula of AO-022/43454261?
The molecular formula of AO-022/43454261 is C23H21N5O.
What is the molecular weight of AO-022/43454261?
The molecular weight of AO-022/43454261 is 383.17 g/mol.
Where can I buy AO-022/43454261?
You can request a quote for AO-022/43454261 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AO-022/43454261?
Yes, KEHONG BIO provides custom synthesis services for AO-022/43454261 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.