![methyl 2-({[1-(4-chlorophenyl)-3-ethoxy-5-oxo-1,5-dihydro-4H-pyrazol-4-yliden]methyl}amino)acetate structure](/static/products/3387/338751-20-5.webp)
methyl 2-({[1-(4-chlorophenyl)-3-ethoxy-5-oxo-1,5-dihydro-4H-pyrazol-4-yliden]methyl}amino)acetate
TL;DR: methyl 2-({[1-(4-chlorophenyl)-3-ethoxy-5-oxo-1,5-dihydro-4H-pyrazol-4-yliden]methyl}amino)acetate (CAS 338751-20-5) is a chemical compound with molecular formula C15H16ClN3O4 and molecular weight 337.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[[2-(4-chlorophenyl)-5-ethoxy-3-oxo-1H-pyrazol-4-yl]methylideneamino]acetate
Also Known As: methyl 2-({[1-(4-chlorophenyl)-3-ethoxy-5-oxo-1,5-dihydro-4H-pyrazol-4-yliden]methyl}amino)acetate, methyl 2-[[2-(4-chlorophenyl)-5-ethoxy-3-oxo-1H-pyrazol-4-yl]methylideneamino]acetate, methyl 2-({[(4Z)-1-(4-chlorophenyl)-3-ethoxy-5-oxo-4,5-dihydro-1H-pyrazol-4-ylidene]methyl}amino)acetate, methyl 2-[[(E)-[1-(4-chlorophenyl)-3-ethoxy-5-oxopyrazol-4-ylidene]methyl]amino]acetate, methyl 2-[[(Z)-[1-(4-chlorophenyl)-3-ethoxy-5-oxopyrazol-4-ylidene]methyl]amino]acetate
| Molecular Formula | C15H16ClN3O4 |
|---|---|
| Molecular Weight | 337.08 g/mol |
| LogP | 1.8096 |
| Topological Polar Surface Area | 85.68 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 337.08295 |
| Heavy Atoms | 23 |
| Complexity | 762.0195 |
Chemical Identifiers
| CAS Number | 338751-20-5 |
|---|---|
| SMILES | CCOC1=C(C(=O)N(N1)C2=CC=C(C=C2)Cl)C=NCC(=O)OC |
Product Overview
methyl 2-({[1-(4-chlorophenyl)-3-ethoxy-5-oxo-1,5-dihydro-4H-pyrazol-4-yliden]methyl}amino)acetate (CAS 338751-20-5), with molecular formula C15H16ClN3O4 and molecular weight 337.08 g/mol. IUPAC: methyl 2-[[2-(4-chlorophenyl)-5-ethoxy-3-oxo-1H-pyrazol-4-yl]methylideneamino]acetate.
Chemical Property Profile of methyl 2-({[1-(4-chlorophenyl)-3-ethoxy-5-oxo-1,5-dihydro-4H-pyrazol-4-yliden]methyl}amino)acetate
Property Insights of methyl 2-({[1-(4-chlorophenyl)-3-ethoxy-5-oxo-1,5-dihydro-4H-pyrazol-4-yliden]methyl}amino)acetate
The XLogP value of 1.8096 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl 2-({[1-(4-chlorophenyl)-3-ethoxy-5-oxo-1,5-dihydro-4H-pyrazol-4-yliden]methyl}amino)acetate. The TPSA of 85.68 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl 2-({[1-(4-chlorophenyl)-3-ethoxy-5-oxo-1,5-dihydro-4H-pyrazol-4-yliden]methyl}amino)acetate. Following Lipinski's Rule of Five, methyl 2-({[1-(4-chlorophenyl)-3-ethoxy-5-oxo-1,5-dihydro-4H-pyrazol-4-yliden]methyl}amino)acetate 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 methyl 2-({[1-(4-chlorophenyl)-3-ethoxy-5-oxo-1,5-dihydro-4H-pyrazol-4-yliden]methyl}amino)acetate?
The CAS number of methyl 2-({[1-(4-chlorophenyl)-3-ethoxy-5-oxo-1,5-dihydro-4H-pyrazol-4-yliden]methyl}amino)acetate is 338751-20-5.
What is the molecular formula of methyl 2-({[1-(4-chlorophenyl)-3-ethoxy-5-oxo-1,5-dihydro-4H-pyrazol-4-yliden]methyl}amino)acetate?
The molecular formula of methyl 2-({[1-(4-chlorophenyl)-3-ethoxy-5-oxo-1,5-dihydro-4H-pyrazol-4-yliden]methyl}amino)acetate is C15H16ClN3O4.
What is the molecular weight of methyl 2-({[1-(4-chlorophenyl)-3-ethoxy-5-oxo-1,5-dihydro-4H-pyrazol-4-yliden]methyl}amino)acetate?
The molecular weight of methyl 2-({[1-(4-chlorophenyl)-3-ethoxy-5-oxo-1,5-dihydro-4H-pyrazol-4-yliden]methyl}amino)acetate is 337.08 g/mol.
Where can I buy methyl 2-({[1-(4-chlorophenyl)-3-ethoxy-5-oxo-1,5-dihydro-4H-pyrazol-4-yliden]methyl}amino)acetate?
You can request a quote for methyl 2-({[1-(4-chlorophenyl)-3-ethoxy-5-oxo-1,5-dihydro-4H-pyrazol-4-yliden]methyl}amino)acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl 2-({[1-(4-chlorophenyl)-3-ethoxy-5-oxo-1,5-dihydro-4H-pyrazol-4-yliden]methyl}amino)acetate?
Yes, KEHONG BIO provides custom synthesis services for methyl 2-({[1-(4-chlorophenyl)-3-ethoxy-5-oxo-1,5-dihydro-4H-pyrazol-4-yliden]methyl}amino)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.