AO-022/43454916
TL;DR: AO-022/43454916 (CAS 902316-33-0) is a chemical compound with molecular formula C18H17N5S and molecular weight 335.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7,13-dimethyl-4-phenyl-10-thia-3,5,6,8,13-pentazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaene
Also Known As: AO-022/43454916, 5,9-dimethyl-2-phenyl-8,9,10,11-tetrahydropyrido[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
| Molecular Formula | C18H17N5S |
|---|---|
| Molecular Weight | 335.12 g/mol |
| LogP | 3.30232 |
| Topological Polar Surface Area | 46.32 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 335.12045 |
| Heavy Atoms | 24 |
| Complexity | 1063.5907 |
Chemical Identifiers
| CAS Number | 902316-33-0 |
|---|---|
| SMILES | CC1=NC2=C(C3=C(S2)CN(CC3)C)C4=NC(=NN14)C5=CC=CC=C5 |
Product Overview
AO-022/43454916 (CAS 902316-33-0), with molecular formula C18H17N5S and molecular weight 335.12 g/mol. IUPAC: 7,13-dimethyl-4-phenyl-10-thia-3,5,6,8,13-pentazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaene.
Chemical Property Profile of AO-022/43454916
Property Insights of AO-022/43454916
The XLogP value of 3.30232 indicates that AO-022/43454916 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.32 Ų, AO-022/43454916 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AO-022/43454916 has 0 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-022/43454916?
The CAS number of AO-022/43454916 is 902316-33-0.
What is the molecular formula of AO-022/43454916?
The molecular formula of AO-022/43454916 is C18H17N5S.
What is the molecular weight of AO-022/43454916?
The molecular weight of AO-022/43454916 is 335.12 g/mol.
Where can I buy AO-022/43454916?
You can request a quote for AO-022/43454916 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AO-022/43454916?
Yes, KEHONG BIO provides custom synthesis services for AO-022/43454916 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.