ethyl 6-amino-4-(4-tert-butylphenyl)-5-cyano-2-phenyl-4H-pyran-3-carboxylate
TL;DR: ethyl 6-amino-4-(4-tert-butylphenyl)-5-cyano-2-phenyl-4H-pyran-3-carboxylate (CAS 354555-85-4) is a chemical compound with molecular formula C25H26N2O3 and molecular weight 402.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 6-amino-4-(4-tert-butylphenyl)-5-cyano-2-phenyl-4H-pyran-3-carboxylate
Also Known As: AM-807/14144023, ethyl 6-amino-4-(4-tert-butylphenyl)-5-cyano-2-phenyl-4H-pyran-3-carboxylate, ethyl 6-amino-4-(4-(tert-butyl)phenyl)-5-cyano-2-phenyl-4H-pyran-3-carboxylate, ethyl 6-amino-4-[4-(tert-butyl)phenyl]-5-cyano-2-phenyl-4H-pyran-3-carboxylate
| Molecular Formula | C25H26N2O3 |
|---|---|
| Molecular Weight | 402.19 g/mol |
| LogP | 4.76618 |
| Topological Polar Surface Area | 85.34 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 402.19434 |
| Heavy Atoms | 30 |
| Complexity | 1036.5416 |
Chemical Identifiers
| CAS Number | 354555-85-4 |
|---|---|
| SMILES | CCOC(=O)C1=C(OC(=C(C1C2=CC=C(C=C2)C(C)(C)C)C#N)N)C3=CC=CC=C3 |
Product Overview
ethyl 6-amino-4-(4-tert-butylphenyl)-5-cyano-2-phenyl-4H-pyran-3-carboxylate (CAS 354555-85-4), with molecular formula C25H26N2O3 and molecular weight 402.19 g/mol. IUPAC: ethyl 6-amino-4-(4-tert-butylphenyl)-5-cyano-2-phenyl-4H-pyran-3-carboxylate.
Chemical Property Profile of ethyl 6-amino-4-(4-tert-butylphenyl)-5-cyano-2-phenyl-4H-pyran-3-carboxylate
Property Insights of ethyl 6-amino-4-(4-tert-butylphenyl)-5-cyano-2-phenyl-4H-pyran-3-carboxylate
The XLogP value of 4.76618 indicates that ethyl 6-amino-4-(4-tert-butylphenyl)-5-cyano-2-phenyl-4H-pyran-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.34 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 6-amino-4-(4-tert-butylphenyl)-5-cyano-2-phenyl-4H-pyran-3-carboxylate. Following Lipinski's Rule of Five, ethyl 6-amino-4-(4-tert-butylphenyl)-5-cyano-2-phenyl-4H-pyran-3-carboxylate 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 ethyl 6-amino-4-(4-tert-butylphenyl)-5-cyano-2-phenyl-4H-pyran-3-carboxylate?
The CAS number of ethyl 6-amino-4-(4-tert-butylphenyl)-5-cyano-2-phenyl-4H-pyran-3-carboxylate is 354555-85-4.
What is the molecular formula of ethyl 6-amino-4-(4-tert-butylphenyl)-5-cyano-2-phenyl-4H-pyran-3-carboxylate?
The molecular formula of ethyl 6-amino-4-(4-tert-butylphenyl)-5-cyano-2-phenyl-4H-pyran-3-carboxylate is C25H26N2O3.
What is the molecular weight of ethyl 6-amino-4-(4-tert-butylphenyl)-5-cyano-2-phenyl-4H-pyran-3-carboxylate?
The molecular weight of ethyl 6-amino-4-(4-tert-butylphenyl)-5-cyano-2-phenyl-4H-pyran-3-carboxylate is 402.19 g/mol.
Where can I buy ethyl 6-amino-4-(4-tert-butylphenyl)-5-cyano-2-phenyl-4H-pyran-3-carboxylate?
You can request a quote for ethyl 6-amino-4-(4-tert-butylphenyl)-5-cyano-2-phenyl-4H-pyran-3-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl 6-amino-4-(4-tert-butylphenyl)-5-cyano-2-phenyl-4H-pyran-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 6-amino-4-(4-tert-butylphenyl)-5-cyano-2-phenyl-4H-pyran-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.