1H-Pyrazole-4-acetic acid, 5-(2-furanyl)-1,3-diphenyl-
TL;DR: 1H-Pyrazole-4-acetic acid, 5-(2-furanyl)-1,3-diphenyl- (CAS 36664-52-5) is a chemical compound with molecular formula C21H16N2O3 and molecular weight 344.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[5-(furan-2-yl)-1,3-diphenylpyrazol-4-yl]acetic acid
Also Known As: 5-1,3-diphenyl-1h-pyrazole-4-aceticacid, 5- -1,3-diphenyl-1H-pyrazole-4-aceticacid, 1H-Pyrazole-4-acetic acid, 5-(2-furanyl)-1,3-diphenyl-, 5-(2-Furanyl)-1,3-diphenyl-1H-pyrazole-4-acetic acid, [5-(2-Furyl)-1,3-diphenyl-1H-pyrazol-4-yl]acetic acid
| Molecular Formula | C21H16N2O3 |
|---|---|
| Molecular Weight | 344.12 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 68.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 344.1161 |
| Heavy Atoms | 26 |
| Complexity | 474.0 |
Chemical Identifiers
| CAS Number | 36664-52-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=NN(C(=C2CC(=O)O)C3=CC=CO3)C4=CC=CC=C4 |
| InChIKey | ZCQAYOKVVSWYNC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1H-Pyrazole-4-acetic acid, 5-(2-furanyl)-1,3-diphenyl- (CAS 36664-52-5), with molecular formula C21H16N2O3 and molecular weight 344.12 g/mol. IUPAC: 2-[5-(furan-2-yl)-1,3-diphenylpyrazol-4-yl]acetic acid.
Chemical Property Profile of 1H-Pyrazole-4-acetic acid, 5-(2-furanyl)-1,3-diphenyl-
Property Insights of 1H-Pyrazole-4-acetic acid, 5-(2-furanyl)-1,3-diphenyl-
The XLogP value of 3.8 indicates that 1H-Pyrazole-4-acetic acid, 5-(2-furanyl)-1,3-diphenyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 1H-Pyrazole-4-acetic acid, 5-(2-furanyl)-1,3-diphenyl-. Following Lipinski's Rule of Five, 1H-Pyrazole-4-acetic acid, 5-(2-furanyl)-1,3-diphenyl- has 1 hydrogen bond donor(s) and 4 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 1H-Pyrazole-4-acetic acid, 5-(2-furanyl)-1,3-diphenyl-?
The CAS number of 1H-Pyrazole-4-acetic acid, 5-(2-furanyl)-1,3-diphenyl- is 36664-52-5.
What is the molecular formula of 1H-Pyrazole-4-acetic acid, 5-(2-furanyl)-1,3-diphenyl-?
The molecular formula of 1H-Pyrazole-4-acetic acid, 5-(2-furanyl)-1,3-diphenyl- is C21H16N2O3.
What is the molecular weight of 1H-Pyrazole-4-acetic acid, 5-(2-furanyl)-1,3-diphenyl-?
The molecular weight of 1H-Pyrazole-4-acetic acid, 5-(2-furanyl)-1,3-diphenyl- is 344.12 g/mol.
Where can I buy 1H-Pyrazole-4-acetic acid, 5-(2-furanyl)-1,3-diphenyl-?
You can request a quote for 1H-Pyrazole-4-acetic acid, 5-(2-furanyl)-1,3-diphenyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Pyrazole-4-acetic acid, 5-(2-furanyl)-1,3-diphenyl-?
Yes, KEHONG BIO provides custom synthesis services for 1H-Pyrazole-4-acetic acid, 5-(2-furanyl)-1,3-diphenyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.