ethyl 4-chloro-5-{(E)-[(2-hydroxyethyl)imino]methyl}-3-methyl-1-benzofuran-2-carboxylate
TL;DR: ethyl 4-chloro-5-{(E)-[(2-hydroxyethyl)imino]methyl}-3-methyl-1-benzofuran-2-carboxylate (CAS 339240-35-6) is a chemical compound with molecular formula C15H16ClNO4 and molecular weight 309.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-chloro-5-(2-hydroxyethyliminomethyl)-3-methyl-1-benzofuran-2-carboxylate
Also Known As: ethyl 4-chloro-5-{(E)-[(2-hydroxyethyl)imino]methyl}-3-methyl-1-benzofuran-2-carboxylate, ethyl 4-chloro-5-(2-hydroxyethyliminomethyl)-3-methyl-1-benzofuran-2-carboxylate, ethyl 4-chloro-5-[(E)-[(2-hydroxyethyl)imino]methyl]-3-methyl-1-benzofuran-2-carboxylate, Ethyl 4-chloro-5-(((2-hydroxyethyl)imino)methyl)-3-methylbenzofuran-2-carboxylate
| Molecular Formula | C15H16ClNO4 |
|---|---|
| Molecular Weight | 309.08 g/mol |
| LogP | 2.98252 |
| Topological Polar Surface Area | 72.03 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 309.07678 |
| Heavy Atoms | 21 |
| Complexity | 690.5287 |
Chemical Identifiers
| CAS Number | 339240-35-6 |
|---|---|
| SMILES | CCOC(=O)C1=C(C2=C(O1)C=CC(=C2Cl)C=NCCO)C |
Product Overview
ethyl 4-chloro-5-{(E)-[(2-hydroxyethyl)imino]methyl}-3-methyl-1-benzofuran-2-carboxylate (CAS 339240-35-6), with molecular formula C15H16ClNO4 and molecular weight 309.08 g/mol. IUPAC: ethyl 4-chloro-5-(2-hydroxyethyliminomethyl)-3-methyl-1-benzofuran-2-carboxylate.
Chemical Property Profile of ethyl 4-chloro-5-{(E)-[(2-hydroxyethyl)imino]methyl}-3-methyl-1-benzofuran-2-carboxylate
Property Insights of ethyl 4-chloro-5-{(E)-[(2-hydroxyethyl)imino]methyl}-3-methyl-1-benzofuran-2-carboxylate
The XLogP value of 2.98252 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl 4-chloro-5-{(E)-[(2-hydroxyethyl)imino]methyl}-3-methyl-1-benzofuran-2-carboxylate. The TPSA of 72.03 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 4-chloro-5-{(E)-[(2-hydroxyethyl)imino]methyl}-3-methyl-1-benzofuran-2-carboxylate. Following Lipinski's Rule of Five, ethyl 4-chloro-5-{(E)-[(2-hydroxyethyl)imino]methyl}-3-methyl-1-benzofuran-2-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 4-chloro-5-{(E)-[(2-hydroxyethyl)imino]methyl}-3-methyl-1-benzofuran-2-carboxylate?
The CAS number of ethyl 4-chloro-5-{(E)-[(2-hydroxyethyl)imino]methyl}-3-methyl-1-benzofuran-2-carboxylate is 339240-35-6.
What is the molecular formula of ethyl 4-chloro-5-{(E)-[(2-hydroxyethyl)imino]methyl}-3-methyl-1-benzofuran-2-carboxylate?
The molecular formula of ethyl 4-chloro-5-{(E)-[(2-hydroxyethyl)imino]methyl}-3-methyl-1-benzofuran-2-carboxylate is C15H16ClNO4.
What is the molecular weight of ethyl 4-chloro-5-{(E)-[(2-hydroxyethyl)imino]methyl}-3-methyl-1-benzofuran-2-carboxylate?
The molecular weight of ethyl 4-chloro-5-{(E)-[(2-hydroxyethyl)imino]methyl}-3-methyl-1-benzofuran-2-carboxylate is 309.08 g/mol.
Where can I buy ethyl 4-chloro-5-{(E)-[(2-hydroxyethyl)imino]methyl}-3-methyl-1-benzofuran-2-carboxylate?
You can request a quote for ethyl 4-chloro-5-{(E)-[(2-hydroxyethyl)imino]methyl}-3-methyl-1-benzofuran-2-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl 4-chloro-5-{(E)-[(2-hydroxyethyl)imino]methyl}-3-methyl-1-benzofuran-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 4-chloro-5-{(E)-[(2-hydroxyethyl)imino]methyl}-3-methyl-1-benzofuran-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.