![ethyl 5-[(3Z)-3-(3-ethyl-4-hydroxy-6-oxocyclohexa-2,4-dien-1-ylidene)-5-methyl-1,2-dihydropyrazol-4-yl]furan-2-carboxylate structure](/static/products/106/106539-56-4.png)
ethyl 5-[(3Z)-3-(3-ethyl-4-hydroxy-6-oxocyclohexa-2,4-dien-1-ylidene)-5-methyl-1,2-dihydropyrazol-4-yl]furan-2-carboxylate
TL;DR: ethyl 5-[(3Z)-3-(3-ethyl-4-hydroxy-6-oxocyclohexa-2,4-dien-1-ylidene)-5-methyl-1,2-dihydropyrazol-4-yl]furan-2-carboxylate (CAS 106539-56-4) is a chemical compound with molecular formula C19H20N2O5 and molecular weight 356.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 5-[3-(5-ethyl-2,4-dihydroxyphenyl)-5-methyl-1H-pyrazol-4-yl]furan-2-carboxylate
Also Known As: ethyl 5-[(3Z)-3-(3-ethyl-4-hydroxy-6-oxocyclohexa-2,4-dien-1-ylidene)-5-methyl-1,2-dihydropyrazol-4-yl]furan-2-carboxylate, ethyl 5-[3-(3-ethyl-4-hydroxy-6-oxocyclohexa-2,4-dien-1-ylidene)-5-methyl-1,2-dihydropyrazol-4-yl]furan-2-carboxylate
| Molecular Formula | C19H20N2O5 |
|---|---|
| Molecular Weight | 356.14 g/mol |
| LogP | 3.79542 |
| Topological Polar Surface Area | 108.58 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 356.1372 |
| Heavy Atoms | 26 |
| Complexity | 954.99286 |
Chemical Identifiers
| CAS Number | 106539-56-4 |
|---|---|
| SMILES | CCC1=CC(=C(C=C1O)O)C2=NNC(=C2C3=CC=C(O3)C(=O)OCC)C |
Product Overview
ethyl 5-[(3Z)-3-(3-ethyl-4-hydroxy-6-oxocyclohexa-2,4-dien-1-ylidene)-5-methyl-1,2-dihydropyrazol-4-yl]furan-2-carboxylate (CAS 106539-56-4), with molecular formula C19H20N2O5 and molecular weight 356.14 g/mol. IUPAC: ethyl 5-[3-(5-ethyl-2,4-dihydroxyphenyl)-5-methyl-1H-pyrazol-4-yl]furan-2-carboxylate.
Chemical Property Profile of ethyl 5-[(3Z)-3-(3-ethyl-4-hydroxy-6-oxocyclohexa-2,4-dien-1-ylidene)-5-methyl-1,2-dihydropyrazol-4-yl]furan-2-carboxylate
Property Insights of ethyl 5-[(3Z)-3-(3-ethyl-4-hydroxy-6-oxocyclohexa-2,4-dien-1-ylidene)-5-methyl-1,2-dihydropyrazol-4-yl]furan-2-carboxylate
The XLogP value of 3.79542 indicates that ethyl 5-[(3Z)-3-(3-ethyl-4-hydroxy-6-oxocyclohexa-2,4-dien-1-ylidene)-5-methyl-1,2-dihydropyrazol-4-yl]furan-2-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 108.58 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 5-[(3Z)-3-(3-ethyl-4-hydroxy-6-oxocyclohexa-2,4-dien-1-ylidene)-5-methyl-1,2-dihydropyrazol-4-yl]furan-2-carboxylate. Following Lipinski's Rule of Five, ethyl 5-[(3Z)-3-(3-ethyl-4-hydroxy-6-oxocyclohexa-2,4-dien-1-ylidene)-5-methyl-1,2-dihydropyrazol-4-yl]furan-2-carboxylate has 3 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 ethyl 5-[(3Z)-3-(3-ethyl-4-hydroxy-6-oxocyclohexa-2,4-dien-1-ylidene)-5-methyl-1,2-dihydropyrazol-4-yl]furan-2-carboxylate?
The CAS number of ethyl 5-[(3Z)-3-(3-ethyl-4-hydroxy-6-oxocyclohexa-2,4-dien-1-ylidene)-5-methyl-1,2-dihydropyrazol-4-yl]furan-2-carboxylate is 106539-56-4.
What is the molecular formula of ethyl 5-[(3Z)-3-(3-ethyl-4-hydroxy-6-oxocyclohexa-2,4-dien-1-ylidene)-5-methyl-1,2-dihydropyrazol-4-yl]furan-2-carboxylate?
The molecular formula of ethyl 5-[(3Z)-3-(3-ethyl-4-hydroxy-6-oxocyclohexa-2,4-dien-1-ylidene)-5-methyl-1,2-dihydropyrazol-4-yl]furan-2-carboxylate is C19H20N2O5.
What is the molecular weight of ethyl 5-[(3Z)-3-(3-ethyl-4-hydroxy-6-oxocyclohexa-2,4-dien-1-ylidene)-5-methyl-1,2-dihydropyrazol-4-yl]furan-2-carboxylate?
The molecular weight of ethyl 5-[(3Z)-3-(3-ethyl-4-hydroxy-6-oxocyclohexa-2,4-dien-1-ylidene)-5-methyl-1,2-dihydropyrazol-4-yl]furan-2-carboxylate is 356.14 g/mol.
Where can I buy ethyl 5-[(3Z)-3-(3-ethyl-4-hydroxy-6-oxocyclohexa-2,4-dien-1-ylidene)-5-methyl-1,2-dihydropyrazol-4-yl]furan-2-carboxylate?
You can request a quote for ethyl 5-[(3Z)-3-(3-ethyl-4-hydroxy-6-oxocyclohexa-2,4-dien-1-ylidene)-5-methyl-1,2-dihydropyrazol-4-yl]furan-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 5-[(3Z)-3-(3-ethyl-4-hydroxy-6-oxocyclohexa-2,4-dien-1-ylidene)-5-methyl-1,2-dihydropyrazol-4-yl]furan-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 5-[(3Z)-3-(3-ethyl-4-hydroxy-6-oxocyclohexa-2,4-dien-1-ylidene)-5-methyl-1,2-dihydropyrazol-4-yl]furan-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.