![[(5-Chloro-2-methoxy-phenyl)-hydrazono]-cyano-acetic acid ethyl ester structure](/static/products/399/3994-30-7.png)
[(5-Chloro-2-methoxy-phenyl)-hydrazono]-cyano-acetic acid ethyl ester
TL;DR: [(5-Chloro-2-methoxy-phenyl)-hydrazono]-cyano-acetic acid ethyl ester (CAS 3994-30-7) is a chemical compound with molecular formula C12H12ClN3O3 and molecular weight 281.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl (2Z)-2-[(5-chloro-2-methoxyphenyl)hydrazinylidene]-2-cyanoacetate
Also Known As: (Z)-ethyl 2-(2-(5-chloro-2-methoxyphenyl)hydrazono)-2-cyanoacetate, [(5-Chloro-2-methoxy-phenyl)-hydrazono]-cyano-acetic acid ethyl ester, ethyl (2Z)-2-[(5-chloro-2-methoxyphenyl)hydrazinylidene]-2-cyanoacetate
| Molecular Formula | C12H12ClN3O3 |
|---|---|
| Molecular Weight | 281.06 g/mol |
| LogP | 2.20318 |
| Topological Polar Surface Area | 83.71 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 281.05673 |
| Heavy Atoms | 19 |
| Complexity | 537.5114 |
Chemical Identifiers
| CAS Number | 3994-30-7 |
|---|---|
| SMILES | CCOC(=O)/C(=N\NC1=C(C=CC(=C1)Cl)OC)/C#N |
Product Overview
[(5-Chloro-2-methoxy-phenyl)-hydrazono]-cyano-acetic acid ethyl ester (CAS 3994-30-7), with molecular formula C12H12ClN3O3 and molecular weight 281.06 g/mol. IUPAC: ethyl (2Z)-2-[(5-chloro-2-methoxyphenyl)hydrazinylidene]-2-cyanoacetate.
Chemical Property Profile of [(5-Chloro-2-methoxy-phenyl)-hydrazono]-cyano-acetic acid ethyl ester
Property Insights of [(5-Chloro-2-methoxy-phenyl)-hydrazono]-cyano-acetic acid ethyl ester
The XLogP value of 2.20318 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [(5-Chloro-2-methoxy-phenyl)-hydrazono]-cyano-acetic acid ethyl ester. The TPSA of 83.71 Ų falls within the moderate polarity range, balancing permeability and solubility for [(5-Chloro-2-methoxy-phenyl)-hydrazono]-cyano-acetic acid ethyl ester. Following Lipinski's Rule of Five, [(5-Chloro-2-methoxy-phenyl)-hydrazono]-cyano-acetic acid ethyl ester 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 [(5-Chloro-2-methoxy-phenyl)-hydrazono]-cyano-acetic acid ethyl ester?
The CAS number of [(5-Chloro-2-methoxy-phenyl)-hydrazono]-cyano-acetic acid ethyl ester is 3994-30-7.
What is the molecular formula of [(5-Chloro-2-methoxy-phenyl)-hydrazono]-cyano-acetic acid ethyl ester?
The molecular formula of [(5-Chloro-2-methoxy-phenyl)-hydrazono]-cyano-acetic acid ethyl ester is C12H12ClN3O3.
What is the molecular weight of [(5-Chloro-2-methoxy-phenyl)-hydrazono]-cyano-acetic acid ethyl ester?
The molecular weight of [(5-Chloro-2-methoxy-phenyl)-hydrazono]-cyano-acetic acid ethyl ester is 281.06 g/mol.
Where can I buy [(5-Chloro-2-methoxy-phenyl)-hydrazono]-cyano-acetic acid ethyl ester?
You can request a quote for [(5-Chloro-2-methoxy-phenyl)-hydrazono]-cyano-acetic acid ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [(5-Chloro-2-methoxy-phenyl)-hydrazono]-cyano-acetic acid ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for [(5-Chloro-2-methoxy-phenyl)-hydrazono]-cyano-acetic acid ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.