AJ-292/40796859
TL;DR: AJ-292/40796859 (CAS 349613-63-4) is a chemical compound with molecular formula C20H16Cl2N2O4 and molecular weight 418.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-[[3-(2,6-dichlorophenyl)-5-methyl-1,2-oxazole-4-carbonyl]amino]benzoate
Also Known As: AJ-292/40796859, ethyl 3-(3-(2,6-dichlorophenyl)-5-methylisoxazole-4-carboxamido)benzoate, ethyl 3-({[3-(2,6-dichlorophenyl)-5-methyl-1,2-oxazol-4-yl]carbonyl}amino)benzoate, Ethyl 3-[[3-(2,6-dichlorophenyl)-5-methyl-1,2-oxazole-4-carbonyl]amino]benzoate, ethyl 3-({[3-(2,6-dichlorophenyl)-5-methyl-4-isoxazolyl]carbonyl}amino)benzoate
| Molecular Formula | C20H16Cl2N2O4 |
|---|---|
| Molecular Weight | 418.05 g/mol |
| LogP | 5.38582 |
| Topological Polar Surface Area | 81.43 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 418.0487 |
| Heavy Atoms | 28 |
| Complexity | 1026.1849 |
Chemical Identifiers
| CAS Number | 349613-63-4 |
|---|---|
| SMILES | CCOC(=O)C1=CC(=CC=C1)NC(=O)C2=C(ON=C2C3=C(C=CC=C3Cl)Cl)C |
Product Overview
AJ-292/40796859 (CAS 349613-63-4), with molecular formula C20H16Cl2N2O4 and molecular weight 418.05 g/mol. IUPAC: ethyl 3-[[3-(2,6-dichlorophenyl)-5-methyl-1,2-oxazole-4-carbonyl]amino]benzoate.
Chemical Property Profile of AJ-292/40796859
Property Insights of AJ-292/40796859
The XLogP value of 5.38582 indicates that AJ-292/40796859 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.43 Ų falls within the moderate polarity range, balancing permeability and solubility for AJ-292/40796859. Following Lipinski's Rule of Five, AJ-292/40796859 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AJ-292/40796859?
The CAS number of AJ-292/40796859 is 349613-63-4.
What is the molecular formula of AJ-292/40796859?
The molecular formula of AJ-292/40796859 is C20H16Cl2N2O4.
What is the molecular weight of AJ-292/40796859?
The molecular weight of AJ-292/40796859 is 418.05 g/mol.
Where can I buy AJ-292/40796859?
You can request a quote for AJ-292/40796859 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AJ-292/40796859?
Yes, KEHONG BIO provides custom synthesis services for AJ-292/40796859 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.