AO-022/43453525
TL;DR: AO-022/43453525 (CAS 846586-17-2) is a chemical compound with molecular formula C26H28N4O3S and molecular weight 476.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(5,5-dimethyl-15-oxo-13-propyl-6-oxa-17-thia-2,12,14-triazatetracyclo[8.7.0.03,8.011,16]heptadeca-1,3(8),9,11(16),12-pentaen-14-yl)-N-(3-methylphenyl)acetamide
Also Known As: AO-022/43453525, 2-(8,8-dimethyl-4-oxo-2-propyl-4,7,8,10-tetrahydro-3H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-3-yl)-N-(m-tolyl)acetamide, 2-(8,8-dimethyl-4-oxo-2-propyl-7,10-dihydro-8H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-3(4H)-yl)-N-(3-methylphenyl)acetamide, 2-(5,5-Dimethyl-15-oxo-13-propyl-6-oxa-17-thia-2,12,14-triazatetracyclo[8.7.0.03,8.011,16]heptadeca-1,3(8),9,11(16),12-pentaen-14-yl)-N-(3-methylphenyl)acetamide
| Molecular Formula | C26H28N4O3S |
|---|---|
| Molecular Weight | 476.19 g/mol |
| LogP | 4.75712 |
| Topological Polar Surface Area | 86.11 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 476.1882 |
| Heavy Atoms | 34 |
| Complexity | 1485.2039 |
Chemical Identifiers
| CAS Number | 846586-17-2 |
|---|---|
| SMILES | CCCC1=NC2=C(C(=O)N1CC(=O)NC3=CC=CC(=C3)C)SC4=C2C=C5COC(CC5=N4)(C)C |
Product Overview
AO-022/43453525 (CAS 846586-17-2), with molecular formula C26H28N4O3S and molecular weight 476.19 g/mol. IUPAC: 2-(5,5-dimethyl-15-oxo-13-propyl-6-oxa-17-thia-2,12,14-triazatetracyclo[8.7.0.03,8.011,16]heptadeca-1,3(8),9,11(16),12-pentaen-14-yl)-N-(3-methylphenyl)acetamide.
Chemical Property Profile of AO-022/43453525
Property Insights of AO-022/43453525
The XLogP value of 4.75712 indicates that AO-022/43453525 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.11 Ų falls within the moderate polarity range, balancing permeability and solubility for AO-022/43453525. Following Lipinski's Rule of Five, AO-022/43453525 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-022/43453525?
The CAS number of AO-022/43453525 is 846586-17-2.
What is the molecular formula of AO-022/43453525?
The molecular formula of AO-022/43453525 is C26H28N4O3S.
What is the molecular weight of AO-022/43453525?
The molecular weight of AO-022/43453525 is 476.19 g/mol.
Where can I buy AO-022/43453525?
You can request a quote for AO-022/43453525 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AO-022/43453525?
Yes, KEHONG BIO provides custom synthesis services for AO-022/43453525 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.