AJ-292/40766311
TL;DR: AJ-292/40766311 (CAS 501915-31-7) is a chemical compound with molecular formula C24H20N2O4 and molecular weight 400.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-(2-amino-3-cyano-5-oxo-7-phenyl-4,6,7,8-tetrahydrochromen-4-yl)benzoate
Also Known As: AJ-292/40766311, methyl 4-(2-amino-3-cyano-5-oxo-7-phenyl-5,6,7,8-tetrahydro-4H-chromen-4-yl)benzoate, methyl 4-(2-amino-3-cyano-5-oxo-7-phenyl-4,6,7,8-tetrahydrochromen-4-yl)benzoate
| Molecular Formula | C24H20N2O4 |
|---|---|
| Molecular Weight | 400.14 g/mol |
| LogP | 3.68168 |
| Topological Polar Surface Area | 102.41 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 400.1423 |
| Heavy Atoms | 30 |
| Complexity | 1108.145 |
Chemical Identifiers
| CAS Number | 501915-31-7 |
|---|---|
| SMILES | COC(=O)C1=CC=C(C=C1)C2C(=C(OC3=C2C(=O)CC(C3)C4=CC=CC=C4)N)C#N |
Product Overview
AJ-292/40766311 (CAS 501915-31-7), with molecular formula C24H20N2O4 and molecular weight 400.14 g/mol. IUPAC: methyl 4-(2-amino-3-cyano-5-oxo-7-phenyl-4,6,7,8-tetrahydrochromen-4-yl)benzoate.
Chemical Property Profile of AJ-292/40766311
Property Insights of AJ-292/40766311
The XLogP value of 3.68168 indicates that AJ-292/40766311 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 102.41 Ų falls within the moderate polarity range, balancing permeability and solubility for AJ-292/40766311. Following Lipinski's Rule of Five, AJ-292/40766311 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 AJ-292/40766311?
The CAS number of AJ-292/40766311 is 501915-31-7.
What is the molecular formula of AJ-292/40766311?
The molecular formula of AJ-292/40766311 is C24H20N2O4.
What is the molecular weight of AJ-292/40766311?
The molecular weight of AJ-292/40766311 is 400.14 g/mol.
Where can I buy AJ-292/40766311?
You can request a quote for AJ-292/40766311 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AJ-292/40766311?
Yes, KEHONG BIO provides custom synthesis services for AJ-292/40766311 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.