![Ethyl 3-[4-(2-chloroacetamido)phenyl]-2-cyanoprop-2-enoate structure](/static/products/3254/325475-51-2.webp)
Ethyl 3-[4-(2-chloroacetamido)phenyl]-2-cyanoprop-2-enoate
TL;DR: Ethyl 3-[4-(2-chloroacetamido)phenyl]-2-cyanoprop-2-enoate (CAS 325475-51-2) is a chemical compound with molecular formula C14H13ClN2O3 and molecular weight 292.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl (Z)-3-[4-[(2-chloroacetyl)amino]phenyl]-2-cyanoprop-2-enoate
Also Known As: ethyl 3-[4-(2-chloroacetamido)phenyl]-2-cyanoprop-2-enoate, Ethyl (Z)-3-[4-[(2-chloroacetyl)amino]phenyl]-2-cyanoprop-2-enoate
| Molecular Formula | C14H13ClN2O3 |
|---|---|
| Molecular Weight | 292.06 g/mol |
| LogP | 2.33398 |
| Topological Polar Surface Area | 79.19 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 292.06146 |
| Heavy Atoms | 20 |
| Complexity | 558.7769 |
Chemical Identifiers
| CAS Number | 325475-51-2 |
|---|---|
| SMILES | CCOC(=O)/C(=C\C1=CC=C(C=C1)NC(=O)CCl)/C#N |
Product Overview
Ethyl 3-[4-(2-chloroacetamido)phenyl]-2-cyanoprop-2-enoate (CAS 325475-51-2), with molecular formula C14H13ClN2O3 and molecular weight 292.06 g/mol. IUPAC: ethyl (Z)-3-[4-[(2-chloroacetyl)amino]phenyl]-2-cyanoprop-2-enoate.
Chemical Property Profile of Ethyl 3-[4-(2-chloroacetamido)phenyl]-2-cyanoprop-2-enoate
Property Insights of Ethyl 3-[4-(2-chloroacetamido)phenyl]-2-cyanoprop-2-enoate
The XLogP value of 2.33398 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 3-[4-(2-chloroacetamido)phenyl]-2-cyanoprop-2-enoate. The TPSA of 79.19 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 3-[4-(2-chloroacetamido)phenyl]-2-cyanoprop-2-enoate. Following Lipinski's Rule of Five, Ethyl 3-[4-(2-chloroacetamido)phenyl]-2-cyanoprop-2-enoate has 1 hydrogen bond donor(s) and 4 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 3-[4-(2-chloroacetamido)phenyl]-2-cyanoprop-2-enoate?
The CAS number of Ethyl 3-[4-(2-chloroacetamido)phenyl]-2-cyanoprop-2-enoate is 325475-51-2.
What is the molecular formula of Ethyl 3-[4-(2-chloroacetamido)phenyl]-2-cyanoprop-2-enoate?
The molecular formula of Ethyl 3-[4-(2-chloroacetamido)phenyl]-2-cyanoprop-2-enoate is C14H13ClN2O3.
What is the molecular weight of Ethyl 3-[4-(2-chloroacetamido)phenyl]-2-cyanoprop-2-enoate?
The molecular weight of Ethyl 3-[4-(2-chloroacetamido)phenyl]-2-cyanoprop-2-enoate is 292.06 g/mol.
Where can I buy Ethyl 3-[4-(2-chloroacetamido)phenyl]-2-cyanoprop-2-enoate?
You can request a quote for Ethyl 3-[4-(2-chloroacetamido)phenyl]-2-cyanoprop-2-enoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 3-[4-(2-chloroacetamido)phenyl]-2-cyanoprop-2-enoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 3-[4-(2-chloroacetamido)phenyl]-2-cyanoprop-2-enoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.