F1808-0196
TL;DR: F1808-0196 (CAS 868224-92-4) is a chemical compound with molecular formula C22H22N2O5 and molecular weight 394.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[2-[2-(2,3-dimethylanilino)-2-oxoethyl]-1-oxoisoquinolin-5-yl]oxyacetate
Also Known As: F1808-0196, methyl 2-[(2-{[(2,3-dimethylphenyl)carbamoyl]methyl}-1-oxo-1,2-dihydroisoquinolin-5-yl)oxy]acetate, methyl 2-[2-[2-(2,3-dimethylanilino)-2-oxoethyl]-1-oxoisoquinolin-5-yl]oxyacetate, methyl 2-((2-(2-((2,3-dimethylphenyl)amino)-2-oxoethyl)-1-oxo-1,2-dihydroisoquinolin-5-yl)oxy)acetate
| Molecular Formula | C22H22N2O5 |
|---|---|
| Molecular Weight | 394.15 g/mol |
| LogP | 2.80884 |
| Topological Polar Surface Area | 86.63 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 394.15286 |
| Heavy Atoms | 29 |
| Complexity | 1133.7411 |
Chemical Identifiers
| CAS Number | 868224-92-4 |
|---|---|
| SMILES | CC1=C(C(=CC=C1)NC(=O)CN2C=CC3=C(C2=O)C=CC=C3OCC(=O)OC)C |
Product Overview
F1808-0196 (CAS 868224-92-4), with molecular formula C22H22N2O5 and molecular weight 394.15 g/mol. IUPAC: methyl 2-[2-[2-(2,3-dimethylanilino)-2-oxoethyl]-1-oxoisoquinolin-5-yl]oxyacetate.
Chemical Property Profile of F1808-0196
Property Insights of F1808-0196
The XLogP value of 2.80884 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F1808-0196. The TPSA of 86.63 Ų falls within the moderate polarity range, balancing permeability and solubility for F1808-0196. Following Lipinski's Rule of Five, F1808-0196 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 F1808-0196?
The CAS number of F1808-0196 is 868224-92-4.
What is the molecular formula of F1808-0196?
The molecular formula of F1808-0196 is C22H22N2O5.
What is the molecular weight of F1808-0196?
The molecular weight of F1808-0196 is 394.15 g/mol.
Where can I buy F1808-0196?
You can request a quote for F1808-0196 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F1808-0196?
Yes, KEHONG BIO provides custom synthesis services for F1808-0196 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.