AE-641/40792772
TL;DR: AE-641/40792772 (CAS 370846-95-0) is a chemical compound with molecular formula C21H19ClN2O4 and molecular weight 398.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 6-chloro-4-(3-methoxycarbonylanilino)-8-methylquinoline-3-carboxylate
Also Known As: AE-641/40792772, ethyl 6-chloro-4-{[3-(methoxycarbonyl)phenyl]amino}-8-methylquinoline-3-carboxylate, ethyl 6-chloro-4-(3-methoxycarbonylanilino)-8-methylquinoline-3-carboxylate, ethyl 6-chloro-4-((3-(methoxycarbonyl)phenyl)amino)-8-methylquinoline-3-carboxylate, ethyl 6-chloro-4-[3-(methoxycarbonyl)anilino]-8-methyl-3-quinolinecarboxylate
| Molecular Formula | C21H19ClN2O4 |
|---|---|
| Molecular Weight | 398.10 g/mol |
| LogP | 4.90352 |
| Topological Polar Surface Area | 77.52 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 398.10333 |
| Heavy Atoms | 28 |
| Complexity | 1065.7001 |
Chemical Identifiers
| CAS Number | 370846-95-0 |
|---|---|
| SMILES | CCOC(=O)C1=CN=C2C(=CC(=CC2=C1NC3=CC=CC(=C3)C(=O)OC)Cl)C |
Product Overview
AE-641/40792772 (CAS 370846-95-0), with molecular formula C21H19ClN2O4 and molecular weight 398.10 g/mol. IUPAC: ethyl 6-chloro-4-(3-methoxycarbonylanilino)-8-methylquinoline-3-carboxylate.
Chemical Property Profile of AE-641/40792772
Property Insights of AE-641/40792772
The XLogP value of 4.90352 indicates that AE-641/40792772 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.52 Ų falls within the moderate polarity range, balancing permeability and solubility for AE-641/40792772. Following Lipinski's Rule of Five, AE-641/40792772 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 AE-641/40792772?
The CAS number of AE-641/40792772 is 370846-95-0.
What is the molecular formula of AE-641/40792772?
The molecular formula of AE-641/40792772 is C21H19ClN2O4.
What is the molecular weight of AE-641/40792772?
The molecular weight of AE-641/40792772 is 398.10 g/mol.
Where can I buy AE-641/40792772?
You can request a quote for AE-641/40792772 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AE-641/40792772?
Yes, KEHONG BIO provides custom synthesis services for AE-641/40792772 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.