AO-081/15572453
TL;DR: AO-081/15572453 (CAS 495384-40-2) is a chemical compound with molecular formula C19H17Cl4NO4 and molecular weight 462.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,7,8,9-tetrachloro-10,10-dimethoxy-4-(2-phenylethyl)-4-azatricyclo[5.2.1.02,6]dec-8-ene-3,5-dione
Also Known As: AO-081/15572453, 1,7,8,9-tetrachloro-10,10-dimethoxy-4-(2-phenylethyl)-4-azatricyclo[5.2.1.0~2,6~]dec-8-ene-3,5-dione, 1,7,8,9-Tetrachloro-10,10-dimethoxy-4-(2-phenylethyl)-4-azatricyclo[5.2.1.02,6]dec-8-ene-3,5-dione
| Molecular Formula | C19H17Cl4NO4 |
|---|---|
| Molecular Weight | 462.99 g/mol |
| LogP | 3.491 |
| Topological Polar Surface Area | 55.84 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 462.99118 |
| Heavy Atoms | 28 |
| Complexity | 841.1796 |
Chemical Identifiers
| CAS Number | 495384-40-2 |
|---|---|
| SMILES | COC1(C2(C3C(C1(C(=C2Cl)Cl)Cl)C(=O)N(C3=O)CCC4=CC=CC=C4)Cl)OC |
Product Overview
AO-081/15572453 (CAS 495384-40-2), with molecular formula C19H17Cl4NO4 and molecular weight 462.99 g/mol. IUPAC: 1,7,8,9-tetrachloro-10,10-dimethoxy-4-(2-phenylethyl)-4-azatricyclo[5.2.1.02,6]dec-8-ene-3,5-dione.
Chemical Property Profile of AO-081/15572453
Property Insights of AO-081/15572453
The XLogP value of 3.491 indicates that AO-081/15572453 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.84 Ų, AO-081/15572453 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AO-081/15572453 has 0 hydrogen bond donor(s) and 4 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-081/15572453?
The CAS number of AO-081/15572453 is 495384-40-2.
What is the molecular formula of AO-081/15572453?
The molecular formula of AO-081/15572453 is C19H17Cl4NO4.
What is the molecular weight of AO-081/15572453?
The molecular weight of AO-081/15572453 is 462.99 g/mol.
Where can I buy AO-081/15572453?
You can request a quote for AO-081/15572453 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AO-081/15572453?
Yes, KEHONG BIO provides custom synthesis services for AO-081/15572453 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.