AB00637213-02
TL;DR: AB00637213-02 (CAS 868223-75-0) is a chemical compound with molecular formula C21H26N2O5 and molecular weight 386.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[2-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-1-oxoisoquinolin-5-yl]oxyacetate
Also Known As: AB00637213-02, F1808-0065, ethyl 2-[2-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-1-oxoisoquinolin-5-yl]oxyacetate, ethyl 2-((2-(2-(4-methylpiperidin-1-yl)-2-oxoethyl)-1-oxo-1,2-dihydroisoquinolin-5-yl)oxy)acetate, ethyl 2-({2-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-1-oxo-1,2-dihydroisoquinolin-5-yl}oxy)acetate
| Molecular Formula | C21H26N2O5 |
|---|---|
| Molecular Weight | 386.18 g/mol |
| LogP | 2.2019 |
| Topological Polar Surface Area | 77.84 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 386.18417 |
| Heavy Atoms | 28 |
| Complexity | 912.64215 |
Chemical Identifiers
| CAS Number | 868223-75-0 |
|---|---|
| SMILES | CCOC(=O)COC1=CC=CC2=C1C=CN(C2=O)CC(=O)N3CCC(CC3)C |
Product Overview
AB00637213-02 (CAS 868223-75-0), with molecular formula C21H26N2O5 and molecular weight 386.18 g/mol. IUPAC: ethyl 2-[2-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-1-oxoisoquinolin-5-yl]oxyacetate.
Chemical Property Profile of AB00637213-02
Property Insights of AB00637213-02
The XLogP value of 2.2019 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00637213-02. The TPSA of 77.84 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00637213-02. Following Lipinski's Rule of Five, AB00637213-02 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 AB00637213-02?
The CAS number of AB00637213-02 is 868223-75-0.
What is the molecular formula of AB00637213-02?
The molecular formula of AB00637213-02 is C21H26N2O5.
What is the molecular weight of AB00637213-02?
The molecular weight of AB00637213-02 is 386.18 g/mol.
Where can I buy AB00637213-02?
You can request a quote for AB00637213-02 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00637213-02?
Yes, KEHONG BIO provides custom synthesis services for AB00637213-02 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.