ethyl 4-{[(1E)-(5-chloro-2-hydroxyphenyl)methylene]amino}benzoate
TL;DR: ethyl 4-{[(1E)-(5-chloro-2-hydroxyphenyl)methylene]amino}benzoate (CAS 22583-82-0) is a chemical compound with molecular formula C16H14ClNO3 and molecular weight 303.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[(5-chloro-2-hydroxyphenyl)methylideneamino]benzoate
Also Known As: ethyl 4-{[(1E)-(5-chloro-2-hydroxyphenyl)methylene]amino}benzoate, Ethyl 4-((5-chloro-2-hydroxybenzylidene)amino)benzoate, (E)-ethyl 4-((5-chloro-2-hydroxybenzylidene)amino)benzoate, ethyl 4-[(5-chloro-2-hydroxyphenyl)methylideneamino]benzoate, ethyl 4-{[(E)-(5-chloro-2-hydroxyphenyl)methylidene]amino}benzoate
| Molecular Formula | C16H14ClNO3 |
|---|---|
| Molecular Weight | 303.07 g/mol |
| LogP | 3.9729 |
| Topological Polar Surface Area | 58.89 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 303.06622 |
| Heavy Atoms | 21 |
| Complexity | 665.72235 |
Chemical Identifiers
| CAS Number | 22583-82-0 |
|---|---|
| SMILES | CCOC(=O)C1=CC=C(C=C1)N=CC2=C(C=CC(=C2)Cl)O |
Product Overview
ethyl 4-{[(1E)-(5-chloro-2-hydroxyphenyl)methylene]amino}benzoate (CAS 22583-82-0), with molecular formula C16H14ClNO3 and molecular weight 303.07 g/mol. IUPAC: ethyl 4-[(5-chloro-2-hydroxyphenyl)methylideneamino]benzoate.
Chemical Property Profile of ethyl 4-{[(1E)-(5-chloro-2-hydroxyphenyl)methylene]amino}benzoate
Property Insights of ethyl 4-{[(1E)-(5-chloro-2-hydroxyphenyl)methylene]amino}benzoate
The XLogP value of 3.9729 indicates that ethyl 4-{[(1E)-(5-chloro-2-hydroxyphenyl)methylene]amino}benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.89 Ų, ethyl 4-{[(1E)-(5-chloro-2-hydroxyphenyl)methylene]amino}benzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ethyl 4-{[(1E)-(5-chloro-2-hydroxyphenyl)methylene]amino}benzoate 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 4-{[(1E)-(5-chloro-2-hydroxyphenyl)methylene]amino}benzoate?
The CAS number of ethyl 4-{[(1E)-(5-chloro-2-hydroxyphenyl)methylene]amino}benzoate is 22583-82-0.
What is the molecular formula of ethyl 4-{[(1E)-(5-chloro-2-hydroxyphenyl)methylene]amino}benzoate?
The molecular formula of ethyl 4-{[(1E)-(5-chloro-2-hydroxyphenyl)methylene]amino}benzoate is C16H14ClNO3.
What is the molecular weight of ethyl 4-{[(1E)-(5-chloro-2-hydroxyphenyl)methylene]amino}benzoate?
The molecular weight of ethyl 4-{[(1E)-(5-chloro-2-hydroxyphenyl)methylene]amino}benzoate is 303.07 g/mol.
Where can I buy ethyl 4-{[(1E)-(5-chloro-2-hydroxyphenyl)methylene]amino}benzoate?
You can request a quote for ethyl 4-{[(1E)-(5-chloro-2-hydroxyphenyl)methylene]amino}benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl 4-{[(1E)-(5-chloro-2-hydroxyphenyl)methylene]amino}benzoate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 4-{[(1E)-(5-chloro-2-hydroxyphenyl)methylene]amino}benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.