1-Phenyl-3-(4-nitrophenyl)-2-pyrazoline
TL;DR: 1-Phenyl-3-(4-nitrophenyl)-2-pyrazoline (CAS 3314-41-8) is a chemical compound with molecular formula C15H13N3O2 and molecular weight 267.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(4-nitrophenyl)-2-phenyl-3,4-dihydropyrazole
Also Known As: 1-Phenyl-3-(4-nitrophenyl)-2-pyrazoline, 3-(4-Nitrophenyl)-1-phenyl-4,5-dihydro-1H-pyrazole, 1h-benzimidazole-2-propanoic acid,5-methyl, 4,5-Dihydro-(1H)-pyrazole derivative, 2k, 5-(4-nitrophenyl)-2-phenyl-3,4-dihydropyrazole
| Molecular Formula | C15H13N3O2 |
|---|---|
| Molecular Weight | 267.10 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 61.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 267.10077 |
| Heavy Atoms | 20 |
| Complexity | 377.0 |
Chemical Identifiers
| CAS Number | 3314-41-8 |
|---|---|
| SMILES | C1CN(N=C1C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CC=C3 |
| InChIKey | MHGHKCBKUYUBGT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Phenyl-3-(4-nitrophenyl)-2-pyrazoline (CAS 3314-41-8), with molecular formula C15H13N3O2 and molecular weight 267.10 g/mol. IUPAC: 5-(4-nitrophenyl)-2-phenyl-3,4-dihydropyrazole.
Chemical Property Profile of 1-Phenyl-3-(4-nitrophenyl)-2-pyrazoline
Property Insights of 1-Phenyl-3-(4-nitrophenyl)-2-pyrazoline
The XLogP value of 3.3 indicates that 1-Phenyl-3-(4-nitrophenyl)-2-pyrazoline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Phenyl-3-(4-nitrophenyl)-2-pyrazoline. Following Lipinski's Rule of Five, 1-Phenyl-3-(4-nitrophenyl)-2-pyrazoline has 0 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 1-Phenyl-3-(4-nitrophenyl)-2-pyrazoline?
The CAS number of 1-Phenyl-3-(4-nitrophenyl)-2-pyrazoline is 3314-41-8.
What is the molecular formula of 1-Phenyl-3-(4-nitrophenyl)-2-pyrazoline?
The molecular formula of 1-Phenyl-3-(4-nitrophenyl)-2-pyrazoline is C15H13N3O2.
What is the molecular weight of 1-Phenyl-3-(4-nitrophenyl)-2-pyrazoline?
The molecular weight of 1-Phenyl-3-(4-nitrophenyl)-2-pyrazoline is 267.10 g/mol.
Where can I buy 1-Phenyl-3-(4-nitrophenyl)-2-pyrazoline?
You can request a quote for 1-Phenyl-3-(4-nitrophenyl)-2-pyrazoline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Phenyl-3-(4-nitrophenyl)-2-pyrazoline?
Yes, KEHONG BIO provides custom synthesis services for 1-Phenyl-3-(4-nitrophenyl)-2-pyrazoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.