AO-022/43390757
TL;DR: AO-022/43390757 (CAS 836638-95-0) is a chemical compound with molecular formula C23H21N5O2 and molecular weight 399.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
17-(4-methoxyphenyl)-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-022/43390757, 3-isobutyl-11-(4-methoxyphenyl)-3H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4(11H)-one, 11-(4-methoxyphenyl)-3-(2-methylpropyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one, 3-isobutyl-11-(4-methoxyphenyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
| Molecular Formula | C23H21N5O2 |
|---|---|
| Molecular Weight | 399.17 g/mol |
| LogP | 3.9482 |
| Topological Polar Surface Area | 74.83 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 399.16953 |
| Heavy Atoms | 30 |
| Complexity | 1448.5416 |
Chemical Identifiers
| CAS Number | 836638-95-0 |
|---|---|
| SMILES | CC(C)CN1C=NC2=C(C1=O)C3=NC4=CC=CC=C4N=C3N2C5=CC=C(C=C5)OC |
Product Overview
AO-022/43390757 (CAS 836638-95-0), with molecular formula C23H21N5O2 and molecular weight 399.17 g/mol. IUPAC: 17-(4-methoxyphenyl)-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-022/43390757
Property Insights of AO-022/43390757
The XLogP value of 3.9482 indicates that AO-022/43390757 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.83 Ų falls within the moderate polarity range, balancing permeability and solubility for AO-022/43390757. Following Lipinski's Rule of Five, AO-022/43390757 has 0 hydrogen bond donor(s) and 5 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-022/43390757?
The CAS number of AO-022/43390757 is 836638-95-0.
What is the molecular formula of AO-022/43390757?
The molecular formula of AO-022/43390757 is C23H21N5O2.
What is the molecular weight of AO-022/43390757?
The molecular weight of AO-022/43390757 is 399.17 g/mol.
Where can I buy AO-022/43390757?
You can request a quote for AO-022/43390757 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AO-022/43390757?
Yes, KEHONG BIO provides custom synthesis services for AO-022/43390757 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.