ethyl 2-amino-6-(chloromethyl)-5-cyano-4-(3-pyridinyl)-4H-pyran-3-carboxylate
TL;DR: ethyl 2-amino-6-(chloromethyl)-5-cyano-4-(3-pyridinyl)-4H-pyran-3-carboxylate (CAS 362494-72-2) is a chemical compound with molecular formula C15H14ClN3O3 and molecular weight 319.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-amino-6-(chloromethyl)-5-cyano-4-pyridin-3-yl-4H-pyran-3-carboxylate
Also Known As: ethyl 2-amino-6-(chloromethyl)-5-cyano-4-(3-pyridinyl)-4H-pyran-3-carboxylate, ethyl 2-amino-6-(chloromethyl)-5-cyano-4-(pyridin-3-yl)-4H-pyran-3-carboxylate, ethyl 2-amino-6-(chloromethyl)-5-cyano-4-pyridin-3-yl-4H-pyran-3-carboxylate, ETHYL 2-AMINO-6-(CHLOROMETHYL)-5-CYANO-4-(3-PYRIDYL)-4H-PYRAN-3-CARBOXYLATE
| Molecular Formula | C15H14ClN3O3 |
|---|---|
| Molecular Weight | 319.07 g/mol |
| LogP | 1.94528 |
| Topological Polar Surface Area | 98.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 319.07236 |
| Heavy Atoms | 22 |
| Complexity | 677.02313 |
Chemical Identifiers
| CAS Number | 362494-72-2 |
|---|---|
| SMILES | CCOC(=O)C1=C(OC(=C(C1C2=CN=CC=C2)C#N)CCl)N |
Product Overview
ethyl 2-amino-6-(chloromethyl)-5-cyano-4-(3-pyridinyl)-4H-pyran-3-carboxylate (CAS 362494-72-2), with molecular formula C15H14ClN3O3 and molecular weight 319.07 g/mol. IUPAC: ethyl 2-amino-6-(chloromethyl)-5-cyano-4-pyridin-3-yl-4H-pyran-3-carboxylate.
Chemical Property Profile of ethyl 2-amino-6-(chloromethyl)-5-cyano-4-(3-pyridinyl)-4H-pyran-3-carboxylate
Property Insights of ethyl 2-amino-6-(chloromethyl)-5-cyano-4-(3-pyridinyl)-4H-pyran-3-carboxylate
The XLogP value of 1.94528 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl 2-amino-6-(chloromethyl)-5-cyano-4-(3-pyridinyl)-4H-pyran-3-carboxylate. The TPSA of 98.23 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 2-amino-6-(chloromethyl)-5-cyano-4-(3-pyridinyl)-4H-pyran-3-carboxylate. Following Lipinski's Rule of Five, ethyl 2-amino-6-(chloromethyl)-5-cyano-4-(3-pyridinyl)-4H-pyran-3-carboxylate 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 ethyl 2-amino-6-(chloromethyl)-5-cyano-4-(3-pyridinyl)-4H-pyran-3-carboxylate?
The CAS number of ethyl 2-amino-6-(chloromethyl)-5-cyano-4-(3-pyridinyl)-4H-pyran-3-carboxylate is 362494-72-2.
What is the molecular formula of ethyl 2-amino-6-(chloromethyl)-5-cyano-4-(3-pyridinyl)-4H-pyran-3-carboxylate?
The molecular formula of ethyl 2-amino-6-(chloromethyl)-5-cyano-4-(3-pyridinyl)-4H-pyran-3-carboxylate is C15H14ClN3O3.
What is the molecular weight of ethyl 2-amino-6-(chloromethyl)-5-cyano-4-(3-pyridinyl)-4H-pyran-3-carboxylate?
The molecular weight of ethyl 2-amino-6-(chloromethyl)-5-cyano-4-(3-pyridinyl)-4H-pyran-3-carboxylate is 319.07 g/mol.
Where can I buy ethyl 2-amino-6-(chloromethyl)-5-cyano-4-(3-pyridinyl)-4H-pyran-3-carboxylate?
You can request a quote for ethyl 2-amino-6-(chloromethyl)-5-cyano-4-(3-pyridinyl)-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 2-amino-6-(chloromethyl)-5-cyano-4-(3-pyridinyl)-4H-pyran-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 2-amino-6-(chloromethyl)-5-cyano-4-(3-pyridinyl)-4H-pyran-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.