AO-022/43454620
TL;DR: AO-022/43454620 (CAS 848915-84-4) is a chemical compound with molecular formula C25H26N4O5S and molecular weight 494.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-oxo-7-(3-propan-2-yloxypropyl)-6-(thiophene-2-carbonylimino)-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaene-5-carboxylate
Also Known As: AO-022/43454620, ethyl 1-(3-isopropoxypropyl)-5-oxo-2-[(2-thienylcarbonyl)imino]-1,5-dihydro-2H-dipyrido[1,2-a:2,3-d]pyrimidine-3-carboxylate, Ethyl 2-oxo-7-(3-propan-2-yloxypropyl)-6-(thiophene-2-carbonylimino)-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaene-5-carboxylate, (Z)-ethyl 1-(3-isopropoxypropyl)-5-oxo-2-((thiophene-2-carbonyl)imino)-2,5-dihydro-1H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxylate, ethyl (2Z)-5-oxo-1-[3-(propan-2-yloxy)propyl]-2-[(thiophen-2-ylcarbonyl)imino]-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxylate
| Molecular Formula | C25H26N4O5S |
|---|---|
| Molecular Weight | 494.16 g/mol |
| LogP | 3.4436 |
| Topological Polar Surface Area | 104.26 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 494.16238 |
| Heavy Atoms | 35 |
| Complexity | 1502.3535 |
Chemical Identifiers
| CAS Number | 848915-84-4 |
|---|---|
| SMILES | CCOC(=O)C1=CC2=C(N=C3C=CC=CN3C2=O)N(C1=NC(=O)C4=CC=CS4)CCCOC(C)C |
Product Overview
AO-022/43454620 (CAS 848915-84-4), with molecular formula C25H26N4O5S and molecular weight 494.16 g/mol. IUPAC: ethyl 2-oxo-7-(3-propan-2-yloxypropyl)-6-(thiophene-2-carbonylimino)-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaene-5-carboxylate.
Chemical Property Profile of AO-022/43454620
Property Insights of AO-022/43454620
The XLogP value of 3.4436 indicates that AO-022/43454620 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 104.26 Ų falls within the moderate polarity range, balancing permeability and solubility for AO-022/43454620. Following Lipinski's Rule of Five, AO-022/43454620 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-022/43454620?
The CAS number of AO-022/43454620 is 848915-84-4.
What is the molecular formula of AO-022/43454620?
The molecular formula of AO-022/43454620 is C25H26N4O5S.
What is the molecular weight of AO-022/43454620?
The molecular weight of AO-022/43454620 is 494.16 g/mol.
Where can I buy AO-022/43454620?
You can request a quote for AO-022/43454620 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AO-022/43454620?
Yes, KEHONG BIO provides custom synthesis services for AO-022/43454620 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.