AO-022/43390531
TL;DR: AO-022/43390531 (CAS 846027-98-3) is a chemical compound with molecular formula C25H25N5O4 and molecular weight 459.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
17-(2,5-dimethoxyphenyl)-13-(3-ethoxypropyl)-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-022/43390531, 11-(2,5-dimethoxyphenyl)-3-(3-ethoxypropyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one, 11-(2,5-dimethoxyphenyl)-3-(3-ethoxypropyl)-3H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4(11H)-one, 17-(2,5-Dimethoxyphenyl)-13-(3-ethoxypropyl)-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
| Molecular Formula | C25H25N5O4 |
|---|---|
| Molecular Weight | 459.19 g/mol |
| LogP | 3.7274 |
| Topological Polar Surface Area | 93.29 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 459.19064 |
| Heavy Atoms | 34 |
| Complexity | 1556.63 |
Chemical Identifiers
| CAS Number | 846027-98-3 |
|---|---|
| SMILES | CCOCCCN1C=NC2=C(C1=O)C3=NC4=CC=CC=C4N=C3N2C5=C(C=CC(=C5)OC)OC |
Product Overview
AO-022/43390531 (CAS 846027-98-3), with molecular formula C25H25N5O4 and molecular weight 459.19 g/mol. IUPAC: 17-(2,5-dimethoxyphenyl)-13-(3-ethoxypropyl)-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-022/43390531
Property Insights of AO-022/43390531
The XLogP value of 3.7274 indicates that AO-022/43390531 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.29 Ų falls within the moderate polarity range, balancing permeability and solubility for AO-022/43390531. Following Lipinski's Rule of Five, AO-022/43390531 has 0 hydrogen bond donor(s) and 7 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-022/43390531?
The CAS number of AO-022/43390531 is 846027-98-3.
What is the molecular formula of AO-022/43390531?
The molecular formula of AO-022/43390531 is C25H25N5O4.
What is the molecular weight of AO-022/43390531?
The molecular weight of AO-022/43390531 is 459.19 g/mol.
Where can I buy AO-022/43390531?
You can request a quote for AO-022/43390531 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AO-022/43390531?
Yes, KEHONG BIO provides custom synthesis services for AO-022/43390531 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.