(2E)-4-[5-(furan-2-yl)-3-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobut-2-enoic acid
TL;DR: (2E)-4-[5-(furan-2-yl)-3-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobut-2-enoic acid (CAS 577960-11-3) is a chemical compound with molecular formula C18H16N2O5 and molecular weight 340.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-4-[3-(furan-2-yl)-5-(4-methoxyphenyl)-3,4-dihydropyrazol-2-yl]-4-oxobut-2-enoic acid
Also Known As: (2E)-4-[5-(furan-2-yl)-3-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobut-2-enoic acid, (2E)-4-[5-(2-furyl)-3-(4-methoxyphenyl)(2-pyrazolinyl)]-4-oxobut-2-enoic acid, 4-[5-(2-furyl)-3-(4-methoxyphenyl)-4,5-dihydropyrazol-1-yl]-4-oxo-but-2-enoic Acid, (E)-4-(5-(furan-2-yl)-3-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl)-4-oxobut-2-enoic acid, (E)-4-[3-(furan-2-yl)-5-(4-methoxyphenyl)-3,4-dihydropyrazol-2-yl]-4-oxobut-2-enoic acid
| Molecular Formula | C18H16N2O5 |
|---|---|
| Molecular Weight | 340.11 g/mol |
| LogP | 2.6067 |
| Topological Polar Surface Area | 92.34 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 340.10593 |
| Heavy Atoms | 25 |
| Complexity | 821.66113 |
Chemical Identifiers
| CAS Number | 577960-11-3 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2=NN(C(C2)C3=CC=CO3)C(=O)/C=C/C(=O)O |
Product Overview
(2E)-4-[5-(furan-2-yl)-3-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobut-2-enoic acid (CAS 577960-11-3), with molecular formula C18H16N2O5 and molecular weight 340.11 g/mol. IUPAC: (E)-4-[3-(furan-2-yl)-5-(4-methoxyphenyl)-3,4-dihydropyrazol-2-yl]-4-oxobut-2-enoic acid.
Chemical Property Profile of (2E)-4-[5-(furan-2-yl)-3-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobut-2-enoic acid
Property Insights of (2E)-4-[5-(furan-2-yl)-3-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobut-2-enoic acid
The XLogP value of 2.6067 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2E)-4-[5-(furan-2-yl)-3-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobut-2-enoic acid. The TPSA of 92.34 Ų falls within the moderate polarity range, balancing permeability and solubility for (2E)-4-[5-(furan-2-yl)-3-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobut-2-enoic acid. Following Lipinski's Rule of Five, (2E)-4-[5-(furan-2-yl)-3-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobut-2-enoic acid 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 (2E)-4-[5-(furan-2-yl)-3-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobut-2-enoic acid?
The CAS number of (2E)-4-[5-(furan-2-yl)-3-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobut-2-enoic acid is 577960-11-3.
What is the molecular formula of (2E)-4-[5-(furan-2-yl)-3-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobut-2-enoic acid?
The molecular formula of (2E)-4-[5-(furan-2-yl)-3-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobut-2-enoic acid is C18H16N2O5.
What is the molecular weight of (2E)-4-[5-(furan-2-yl)-3-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobut-2-enoic acid?
The molecular weight of (2E)-4-[5-(furan-2-yl)-3-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobut-2-enoic acid is 340.11 g/mol.
Where can I buy (2E)-4-[5-(furan-2-yl)-3-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobut-2-enoic acid?
You can request a quote for (2E)-4-[5-(furan-2-yl)-3-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobut-2-enoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2E)-4-[5-(furan-2-yl)-3-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobut-2-enoic acid?
Yes, KEHONG BIO provides custom synthesis services for (2E)-4-[5-(furan-2-yl)-3-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobut-2-enoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.