AO-022/43455381
TL;DR: AO-022/43455381 (CAS 899402-71-2) is a chemical compound with molecular formula C18H16N4OS and molecular weight 336.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(15-methyl-10-thia-3,5,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaen-4-yl)phenol
Also Known As: AO-022/43455381, 3-(11-methyl-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl)phenol, 3-(11-methyl-8,9,10,11-tetrahydrobenzo[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl)phenol
| Molecular Formula | C18H16N4OS |
|---|---|
| Molecular Weight | 336.10 g/mol |
| LogP | 4.1514 |
| Topological Polar Surface Area | 63.31 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 336.1045 |
| Heavy Atoms | 24 |
| Complexity | 1081.4503 |
Chemical Identifiers
| CAS Number | 899402-71-2 |
|---|---|
| SMILES | CC1CCCC2=C1C3=C(S2)N=CN4C3=NC(=N4)C5=CC(=CC=C5)O |
Product Overview
AO-022/43455381 (CAS 899402-71-2), with molecular formula C18H16N4OS and molecular weight 336.10 g/mol. IUPAC: 3-(15-methyl-10-thia-3,5,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaen-4-yl)phenol.
Chemical Property Profile of AO-022/43455381
Property Insights of AO-022/43455381
The XLogP value of 4.1514 indicates that AO-022/43455381 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.31 Ų falls within the moderate polarity range, balancing permeability and solubility for AO-022/43455381. Following Lipinski's Rule of Five, AO-022/43455381 has 1 hydrogen bond donor(s) and 5 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-022/43455381?
The CAS number of AO-022/43455381 is 899402-71-2.
What is the molecular formula of AO-022/43455381?
The molecular formula of AO-022/43455381 is C18H16N4OS.
What is the molecular weight of AO-022/43455381?
The molecular weight of AO-022/43455381 is 336.10 g/mol.
Where can I buy AO-022/43455381?
You can request a quote for AO-022/43455381 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AO-022/43455381?
Yes, KEHONG BIO provides custom synthesis services for AO-022/43455381 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.