![3-[3-(3-nitrophenyl)-1-phenyl-1H-pyrazol-4-yl]prop-2-enoic acid structure](/static/products/3812/381214-35-3.webp)
3-[3-(3-nitrophenyl)-1-phenyl-1H-pyrazol-4-yl]prop-2-enoic acid
TL;DR: 3-[3-(3-nitrophenyl)-1-phenyl-1H-pyrazol-4-yl]prop-2-enoic acid (CAS 381214-35-3) is a chemical compound with molecular formula C18H13N3O4 and molecular weight 335.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-3-[3-(3-nitrophenyl)-1-phenylpyrazol-4-yl]prop-2-enoic acid
Also Known As: 3-[3-(3-nitrophenyl)-1-phenyl-1H-pyrazol-4-yl]prop-2-enoic acid, (E)-3-[3-(3-nitrophenyl)-1-phenylpyrazol-4-yl]prop-2-enoic acid, J2.017.711J, 3-[3-(3-Nitro-phenyl)-1-phenyl-1H-pyrazol-4-yl]-acrylic acid, (2E)-3-[3-(3-nitrophenyl)-1-phenyl-1H-pyrazol-4-yl]prop-2-enoic acid
| Molecular Formula | C18H13N3O4 |
|---|---|
| Molecular Weight | 335.09 g/mol |
| LogP | 3.5453 |
| Topological Polar Surface Area | 98.26 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 335.0906 |
| Heavy Atoms | 25 |
| Complexity | 961.46234 |
Chemical Identifiers
| CAS Number | 381214-35-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC(=CC=C3)[N+](=O)[O-])/C=C/C(=O)O |
Product Overview
3-[3-(3-nitrophenyl)-1-phenyl-1H-pyrazol-4-yl]prop-2-enoic acid (CAS 381214-35-3), with molecular formula C18H13N3O4 and molecular weight 335.09 g/mol. IUPAC: (E)-3-[3-(3-nitrophenyl)-1-phenylpyrazol-4-yl]prop-2-enoic acid.
Chemical Property Profile of 3-[3-(3-nitrophenyl)-1-phenyl-1H-pyrazol-4-yl]prop-2-enoic acid
Property Insights of 3-[3-(3-nitrophenyl)-1-phenyl-1H-pyrazol-4-yl]prop-2-enoic acid
The XLogP value of 3.5453 indicates that 3-[3-(3-nitrophenyl)-1-phenyl-1H-pyrazol-4-yl]prop-2-enoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 98.26 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[3-(3-nitrophenyl)-1-phenyl-1H-pyrazol-4-yl]prop-2-enoic acid. Following Lipinski's Rule of Five, 3-[3-(3-nitrophenyl)-1-phenyl-1H-pyrazol-4-yl]prop-2-enoic acid 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 3-[3-(3-nitrophenyl)-1-phenyl-1H-pyrazol-4-yl]prop-2-enoic acid?
The CAS number of 3-[3-(3-nitrophenyl)-1-phenyl-1H-pyrazol-4-yl]prop-2-enoic acid is 381214-35-3.
What is the molecular formula of 3-[3-(3-nitrophenyl)-1-phenyl-1H-pyrazol-4-yl]prop-2-enoic acid?
The molecular formula of 3-[3-(3-nitrophenyl)-1-phenyl-1H-pyrazol-4-yl]prop-2-enoic acid is C18H13N3O4.
What is the molecular weight of 3-[3-(3-nitrophenyl)-1-phenyl-1H-pyrazol-4-yl]prop-2-enoic acid?
The molecular weight of 3-[3-(3-nitrophenyl)-1-phenyl-1H-pyrazol-4-yl]prop-2-enoic acid is 335.09 g/mol.
Where can I buy 3-[3-(3-nitrophenyl)-1-phenyl-1H-pyrazol-4-yl]prop-2-enoic acid?
You can request a quote for 3-[3-(3-nitrophenyl)-1-phenyl-1H-pyrazol-4-yl]prop-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 3-[3-(3-nitrophenyl)-1-phenyl-1H-pyrazol-4-yl]prop-2-enoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-[3-(3-nitrophenyl)-1-phenyl-1H-pyrazol-4-yl]prop-2-enoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.