AO-022/43452980
TL;DR: AO-022/43452980 (CAS 903859-36-9) is a chemical compound with molecular formula C18H27N3O3S2 and molecular weight 397.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-[(11,11-dimethyl-4-propylsulfanyl-12-oxa-8-thia-3,5-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5-tetraen-6-yl)amino]ethoxy]ethanol
Also Known As: AO-022/43452980, 2-(2-{[7,7-dimethyl-2-(propylsulfanyl)-6,9-dihydro-7H-pyrano[3',4':4,5]thieno[3,2-d]pyrimidin-4-yl]amino}ethoxy)ethanol, 2-[2-[(11,11-Dimethyl-4-propylsulfanyl-12-oxa-8-thia-3,5-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5-tetraen-6-yl)amino]ethoxy]ethanol, 2-(2-((7,7-dimethyl-2-(propylthio)-7,9-dihydro-6H-pyrano[3',4':4,5]thieno[3,2-d]pyrimidin-4-yl)amino)ethoxy)ethanol, 2-[2-[(7,7-dimethyl-2-propylsulfanyl-6,9-dihydropyrano[2,3]thieno[2,4-b]pyrimidin-4-yl)amino]ethoxy]ethanol
| Molecular Formula | C18H27N3O3S2 |
|---|---|
| Molecular Weight | 397.15 g/mol |
| LogP | 3.4655 |
| Topological Polar Surface Area | 76.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 9 |
| Exact Mass | 397.14938 |
| Heavy Atoms | 26 |
| Complexity | 748.8468 |
Chemical Identifiers
| CAS Number | 903859-36-9 |
|---|---|
| SMILES | CCCSC1=NC2=C(C(=N1)NCCOCCO)SC3=C2COC(C3)(C)C |
Product Overview
AO-022/43452980 (CAS 903859-36-9), with molecular formula C18H27N3O3S2 and molecular weight 397.15 g/mol. IUPAC: 2-[2-[(11,11-dimethyl-4-propylsulfanyl-12-oxa-8-thia-3,5-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5-tetraen-6-yl)amino]ethoxy]ethanol.
Chemical Property Profile of AO-022/43452980
Property Insights of AO-022/43452980
The XLogP value of 3.4655 indicates that AO-022/43452980 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.5 Ų falls within the moderate polarity range, balancing permeability and solubility for AO-022/43452980. Following Lipinski's Rule of Five, AO-022/43452980 has 2 hydrogen bond donor(s) and 8 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-022/43452980?
The CAS number of AO-022/43452980 is 903859-36-9.
What is the molecular formula of AO-022/43452980?
The molecular formula of AO-022/43452980 is C18H27N3O3S2.
What is the molecular weight of AO-022/43452980?
The molecular weight of AO-022/43452980 is 397.15 g/mol.
Where can I buy AO-022/43452980?
You can request a quote for AO-022/43452980 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AO-022/43452980?
Yes, KEHONG BIO provides custom synthesis services for AO-022/43452980 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.