AO-022/43454912
TL;DR: AO-022/43454912 (CAS 902323-14-2) is a chemical compound with molecular formula C20H20N4O3S and molecular weight 396.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(4-methoxyphenoxy)methyl]-14,14-dimethyl-13-oxa-10-thia-3,5,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaene
Also Known As: AO-022/43454912, 2-((4-methoxyphenoxy)methyl)-10,10-dimethyl-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine, 2-[(4-methoxyphenoxy)methyl]-10,10-dimethyl-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine, 4-[(4-Methoxyphenoxy)methyl]-14,14-dimethyl-13-oxa-10-thia-3,5,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaene
| Molecular Formula | C20H20N4O3S |
|---|---|
| Molecular Weight | 396.13 g/mol |
| LogP | 3.7779 |
| Topological Polar Surface Area | 70.77 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 396.1256 |
| Heavy Atoms | 28 |
| Complexity | 1163.8438 |
Chemical Identifiers
| CAS Number | 902323-14-2 |
|---|---|
| SMILES | CC1(CC2=C(CO1)SC3=C2C4=NC(=NN4C=N3)COC5=CC=C(C=C5)OC)C |
Product Overview
AO-022/43454912 (CAS 902323-14-2), with molecular formula C20H20N4O3S and molecular weight 396.13 g/mol. IUPAC: 4-[(4-methoxyphenoxy)methyl]-14,14-dimethyl-13-oxa-10-thia-3,5,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaene.
Chemical Property Profile of AO-022/43454912
Property Insights of AO-022/43454912
The XLogP value of 3.7779 indicates that AO-022/43454912 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.77 Ų falls within the moderate polarity range, balancing permeability and solubility for AO-022/43454912. Following Lipinski's Rule of Five, AO-022/43454912 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-022/43454912?
The CAS number of AO-022/43454912 is 902323-14-2.
What is the molecular formula of AO-022/43454912?
The molecular formula of AO-022/43454912 is C20H20N4O3S.
What is the molecular weight of AO-022/43454912?
The molecular weight of AO-022/43454912 is 396.13 g/mol.
Where can I buy AO-022/43454912?
You can request a quote for AO-022/43454912 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AO-022/43454912?
Yes, KEHONG BIO provides custom synthesis services for AO-022/43454912 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.