AO-022/43453481
TL;DR: AO-022/43453481 (CAS 846597-42-0) is a chemical compound with molecular formula C18H22N4OS and molecular weight 342.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-methoxyethyl)-7-propyl-10-thia-8,13,15-triazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2(6),7,11(16),12,14-hexaen-12-amine
Also Known As: AO-022/43453481, N-(2-methoxyethyl)-4-propyl-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-amine, N-(2-methoxyethyl)-N-(4-propyl-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-yl)amine
| Molecular Formula | C18H22N4OS |
|---|---|
| Molecular Weight | 342.15 g/mol |
| LogP | 3.739 |
| Topological Polar Surface Area | 59.93 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 342.15143 |
| Heavy Atoms | 24 |
| Complexity | 889.7279 |
Chemical Identifiers
| CAS Number | 846597-42-0 |
|---|---|
| SMILES | CCCC1=NC2=C(C3=C1CCC3)C4=C(S2)C(=NC=N4)NCCOC |
Product Overview
AO-022/43453481 (CAS 846597-42-0), with molecular formula C18H22N4OS and molecular weight 342.15 g/mol. IUPAC: N-(2-methoxyethyl)-7-propyl-10-thia-8,13,15-triazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2(6),7,11(16),12,14-hexaen-12-amine.
Chemical Property Profile of AO-022/43453481
Property Insights of AO-022/43453481
The XLogP value of 3.739 indicates that AO-022/43453481 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.93 Ų, AO-022/43453481 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AO-022/43453481 has 1 hydrogen bond donor(s) and 6 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-022/43453481?
The CAS number of AO-022/43453481 is 846597-42-0.
What is the molecular formula of AO-022/43453481?
The molecular formula of AO-022/43453481 is C18H22N4OS.
What is the molecular weight of AO-022/43453481?
The molecular weight of AO-022/43453481 is 342.15 g/mol.
Where can I buy AO-022/43453481?
You can request a quote for AO-022/43453481 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AO-022/43453481?
Yes, KEHONG BIO provides custom synthesis services for AO-022/43453481 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.