![methyl 4-[2-amino-3-cyano-7-methyl-5-oxo-6-(2-phenylethyl)-5,6-dihydro-4H-pyrano[3,2-c]pyridin-4-yl]benzoate structure](/static/products/825/825662-07-5.png)
methyl 4-[2-amino-3-cyano-7-methyl-5-oxo-6-(2-phenylethyl)-5,6-dihydro-4H-pyrano[3,2-c]pyridin-4-yl]benzoate
TL;DR: methyl 4-[2-amino-3-cyano-7-methyl-5-oxo-6-(2-phenylethyl)-5,6-dihydro-4H-pyrano[3,2-c]pyridin-4-yl]benzoate (CAS 825662-07-5) is a chemical compound with molecular formula C26H23N3O4 and molecular weight 441.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-[2-amino-3-cyano-7-methyl-5-oxo-6-(2-phenylethyl)-4H-pyrano[3,2-c]pyridin-4-yl]benzoate
Also Known As: methyl 4-[2-amino-3-cyano-7-methyl-5-oxo-6-(2-phenylethyl)-5,6-dihydro-4H-pyrano[3,2-c]pyridin-4-yl]benzoate, methyl 4-(2-amino-3-cyano-7-methyl-5-oxo-6-phenethyl-4H-pyrano[3,2-c]pyridin-4-yl)benzoate, methyl 4-(2-amino-3-cyano-7-methyl-5-oxo-6-phenethyl-5,6-dihydro-4H-pyrano[3,2-c]pyridin-4-yl)benzoate, methyl 4-[2-amino-3-cyano-7-methyl-5-oxo-6-(2-phenylethyl)-6-hydro-4H-pyrano[3 ,2-c]pyridin-4-yl]benzoate
| Molecular Formula | C26H23N3O4 |
|---|---|
| Molecular Weight | 441.17 g/mol |
| LogP | 3.4042 |
| Topological Polar Surface Area | 107.34 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 441.16885 |
| Heavy Atoms | 33 |
| Complexity | 1332.9353 |
Chemical Identifiers
| CAS Number | 825662-07-5 |
|---|---|
| SMILES | CC1=CC2=C(C(C(=C(O2)N)C#N)C3=CC=C(C=C3)C(=O)OC)C(=O)N1CCC4=CC=CC=C4 |
Product Overview
methyl 4-[2-amino-3-cyano-7-methyl-5-oxo-6-(2-phenylethyl)-5,6-dihydro-4H-pyrano[3,2-c]pyridin-4-yl]benzoate (CAS 825662-07-5), with molecular formula C26H23N3O4 and molecular weight 441.17 g/mol. IUPAC: methyl 4-[2-amino-3-cyano-7-methyl-5-oxo-6-(2-phenylethyl)-4H-pyrano[3,2-c]pyridin-4-yl]benzoate.
Chemical Property Profile of methyl 4-[2-amino-3-cyano-7-methyl-5-oxo-6-(2-phenylethyl)-5,6-dihydro-4H-pyrano[3,2-c]pyridin-4-yl]benzoate
Property Insights of methyl 4-[2-amino-3-cyano-7-methyl-5-oxo-6-(2-phenylethyl)-5,6-dihydro-4H-pyrano[3,2-c]pyridin-4-yl]benzoate
The XLogP value of 3.4042 indicates that methyl 4-[2-amino-3-cyano-7-methyl-5-oxo-6-(2-phenylethyl)-5,6-dihydro-4H-pyrano[3,2-c]pyridin-4-yl]benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 107.34 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl 4-[2-amino-3-cyano-7-methyl-5-oxo-6-(2-phenylethyl)-5,6-dihydro-4H-pyrano[3,2-c]pyridin-4-yl]benzoate. Following Lipinski's Rule of Five, methyl 4-[2-amino-3-cyano-7-methyl-5-oxo-6-(2-phenylethyl)-5,6-dihydro-4H-pyrano[3,2-c]pyridin-4-yl]benzoate 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 methyl 4-[2-amino-3-cyano-7-methyl-5-oxo-6-(2-phenylethyl)-5,6-dihydro-4H-pyrano[3,2-c]pyridin-4-yl]benzoate?
The CAS number of methyl 4-[2-amino-3-cyano-7-methyl-5-oxo-6-(2-phenylethyl)-5,6-dihydro-4H-pyrano[3,2-c]pyridin-4-yl]benzoate is 825662-07-5.
What is the molecular formula of methyl 4-[2-amino-3-cyano-7-methyl-5-oxo-6-(2-phenylethyl)-5,6-dihydro-4H-pyrano[3,2-c]pyridin-4-yl]benzoate?
The molecular formula of methyl 4-[2-amino-3-cyano-7-methyl-5-oxo-6-(2-phenylethyl)-5,6-dihydro-4H-pyrano[3,2-c]pyridin-4-yl]benzoate is C26H23N3O4.
What is the molecular weight of methyl 4-[2-amino-3-cyano-7-methyl-5-oxo-6-(2-phenylethyl)-5,6-dihydro-4H-pyrano[3,2-c]pyridin-4-yl]benzoate?
The molecular weight of methyl 4-[2-amino-3-cyano-7-methyl-5-oxo-6-(2-phenylethyl)-5,6-dihydro-4H-pyrano[3,2-c]pyridin-4-yl]benzoate is 441.17 g/mol.
Where can I buy methyl 4-[2-amino-3-cyano-7-methyl-5-oxo-6-(2-phenylethyl)-5,6-dihydro-4H-pyrano[3,2-c]pyridin-4-yl]benzoate?
You can request a quote for methyl 4-[2-amino-3-cyano-7-methyl-5-oxo-6-(2-phenylethyl)-5,6-dihydro-4H-pyrano[3,2-c]pyridin-4-yl]benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl 4-[2-amino-3-cyano-7-methyl-5-oxo-6-(2-phenylethyl)-5,6-dihydro-4H-pyrano[3,2-c]pyridin-4-yl]benzoate?
Yes, KEHONG BIO provides custom synthesis services for methyl 4-[2-amino-3-cyano-7-methyl-5-oxo-6-(2-phenylethyl)-5,6-dihydro-4H-pyrano[3,2-c]pyridin-4-yl]benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.