![3-[5-({1-[4-(Methoxycarbonyl)phenyl]-3,5-dioxopyrazolidin-4-ylidene}methyl)furan-2-yl]benzoic acid structure](/static/products/6167/6167-12-0.webp)
3-[5-({1-[4-(Methoxycarbonyl)phenyl]-3,5-dioxopyrazolidin-4-ylidene}methyl)furan-2-yl]benzoic acid
TL;DR: 3-[5-({1-[4-(Methoxycarbonyl)phenyl]-3,5-dioxopyrazolidin-4-ylidene}methyl)furan-2-yl]benzoic acid (CAS 6167-12-0) is a chemical compound with molecular formula C23H16N2O7 and molecular weight 432.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[5-[[1-(4-methoxycarbonylphenyl)-3,5-dioxopyrazolidin-4-ylidene]methyl]furan-2-yl]benzoic acid
Also Known As: 3-[5-({1-[4-(Methoxycarbonyl)phenyl]-3,5-dioxopyrazolidin-4-ylidene}methyl)furan-2-yl]benzoic acid, 3-[5-[[1-(4-methoxycarbonylphenyl)-3,5-dioxo-pyrazolidin-4-ylidene]methyl]-2-furyl]benzoic Acid, 3-[5-[[1-(4-methoxycarbonylphenyl)-3,5-dioxopyrazolidin-4-ylidene]methyl]furan-2-yl]benzoic acid
| Molecular Formula | C23H16N2O7 |
|---|---|
| Molecular Weight | 432.10 g/mol |
| LogP | 2.8928 |
| Topological Polar Surface Area | 126.15 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 432.09576 |
| Heavy Atoms | 32 |
| Complexity | 1271.5068 |
Chemical Identifiers
| CAS Number | 6167-12-0 |
|---|---|
| SMILES | COC(=O)C1=CC=C(C=C1)N2C(=O)C(=CC3=CC=C(O3)C4=CC(=CC=C4)C(=O)O)C(=O)N2 |
Product Overview
3-[5-({1-[4-(Methoxycarbonyl)phenyl]-3,5-dioxopyrazolidin-4-ylidene}methyl)furan-2-yl]benzoic acid (CAS 6167-12-0), with molecular formula C23H16N2O7 and molecular weight 432.10 g/mol. IUPAC: 3-[5-[[1-(4-methoxycarbonylphenyl)-3,5-dioxopyrazolidin-4-ylidene]methyl]furan-2-yl]benzoic acid.
Chemical Property Profile of 3-[5-({1-[4-(Methoxycarbonyl)phenyl]-3,5-dioxopyrazolidin-4-ylidene}methyl)furan-2-yl]benzoic acid
Property Insights of 3-[5-({1-[4-(Methoxycarbonyl)phenyl]-3,5-dioxopyrazolidin-4-ylidene}methyl)furan-2-yl]benzoic acid
The XLogP value of 2.8928 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[5-({1-[4-(Methoxycarbonyl)phenyl]-3,5-dioxopyrazolidin-4-ylidene}methyl)furan-2-yl]benzoic acid. The TPSA of 126.15 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[5-({1-[4-(Methoxycarbonyl)phenyl]-3,5-dioxopyrazolidin-4-ylidene}methyl)furan-2-yl]benzoic acid. Following Lipinski's Rule of Five, 3-[5-({1-[4-(Methoxycarbonyl)phenyl]-3,5-dioxopyrazolidin-4-ylidene}methyl)furan-2-yl]benzoic acid has 2 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 3-[5-({1-[4-(Methoxycarbonyl)phenyl]-3,5-dioxopyrazolidin-4-ylidene}methyl)furan-2-yl]benzoic acid?
The CAS number of 3-[5-({1-[4-(Methoxycarbonyl)phenyl]-3,5-dioxopyrazolidin-4-ylidene}methyl)furan-2-yl]benzoic acid is 6167-12-0.
What is the molecular formula of 3-[5-({1-[4-(Methoxycarbonyl)phenyl]-3,5-dioxopyrazolidin-4-ylidene}methyl)furan-2-yl]benzoic acid?
The molecular formula of 3-[5-({1-[4-(Methoxycarbonyl)phenyl]-3,5-dioxopyrazolidin-4-ylidene}methyl)furan-2-yl]benzoic acid is C23H16N2O7.
What is the molecular weight of 3-[5-({1-[4-(Methoxycarbonyl)phenyl]-3,5-dioxopyrazolidin-4-ylidene}methyl)furan-2-yl]benzoic acid?
The molecular weight of 3-[5-({1-[4-(Methoxycarbonyl)phenyl]-3,5-dioxopyrazolidin-4-ylidene}methyl)furan-2-yl]benzoic acid is 432.10 g/mol.
Where can I buy 3-[5-({1-[4-(Methoxycarbonyl)phenyl]-3,5-dioxopyrazolidin-4-ylidene}methyl)furan-2-yl]benzoic acid?
You can request a quote for 3-[5-({1-[4-(Methoxycarbonyl)phenyl]-3,5-dioxopyrazolidin-4-ylidene}methyl)furan-2-yl]benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[5-({1-[4-(Methoxycarbonyl)phenyl]-3,5-dioxopyrazolidin-4-ylidene}methyl)furan-2-yl]benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-[5-({1-[4-(Methoxycarbonyl)phenyl]-3,5-dioxopyrazolidin-4-ylidene}methyl)furan-2-yl]benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.