AO-022/43452737
TL;DR: AO-022/43452737 (CAS 848736-90-3) is a chemical compound with molecular formula C16H23N3O2S2 and molecular weight 353.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-methoxypropyl)-12,12-dimethyl-5-methylsulfanyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6-tetraen-3-amine
Also Known As: AO-022/43452737, N-(3-methoxypropyl)-6,6-dimethyl-2-(methylsulfanyl)-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-amine, N-(3-methoxypropyl)-6,6-dimethyl-2-(methylthio)-6,8-dihydro-5H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-amine, N-[6,6-dimethyl-2-(methylsulfanyl)-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl]-N-(3-methoxypropyl)amine
| Molecular Formula | C16H23N3O2S2 |
|---|---|
| Molecular Weight | 353.12 g/mol |
| LogP | 3.7129 |
| Topological Polar Surface Area | 56.27 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 353.12317 |
| Heavy Atoms | 23 |
| Complexity | 700.1804 |
Chemical Identifiers
| CAS Number | 848736-90-3 |
|---|---|
| SMILES | CC1(CC2=C(CO1)SC3=NC(=NC(=C23)NCCCOC)SC)C |
Product Overview
AO-022/43452737 (CAS 848736-90-3), with molecular formula C16H23N3O2S2 and molecular weight 353.12 g/mol. IUPAC: N-(3-methoxypropyl)-12,12-dimethyl-5-methylsulfanyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6-tetraen-3-amine.
Chemical Property Profile of AO-022/43452737
Property Insights of AO-022/43452737
The XLogP value of 3.7129 indicates that AO-022/43452737 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.27 Ų, AO-022/43452737 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AO-022/43452737 has 1 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-022/43452737?
The CAS number of AO-022/43452737 is 848736-90-3.
What is the molecular formula of AO-022/43452737?
The molecular formula of AO-022/43452737 is C16H23N3O2S2.
What is the molecular weight of AO-022/43452737?
The molecular weight of AO-022/43452737 is 353.12 g/mol.
Where can I buy AO-022/43452737?
You can request a quote for AO-022/43452737 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AO-022/43452737?
Yes, KEHONG BIO provides custom synthesis services for AO-022/43452737 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.