3-(3-nitrophenyl)-1-phenyl-1H-pyrazole-4-carbaldehyde
TL;DR: 3-(3-nitrophenyl)-1-phenyl-1H-pyrazole-4-carbaldehyde (CAS 333327-63-2) is a chemical compound with molecular formula C16H11N3O3 and molecular weight 293.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(3-nitrophenyl)-1-phenylpyrazole-4-carbaldehyde
Also Known As: 3-(3-nitrophenyl)-1-phenyl-1H-pyrazole-4-carbaldehyde, 3-(3-nitrophenyl)-1-phenylpyrazole-4-carbaldehyde, BAS 02234788, UPCMLD0ENAT0504-3120:001, J3.119.861E
| Molecular Formula | C16H11N3O3 |
|---|---|
| Molecular Weight | 293.08 g/mol |
| LogP | 3.26 |
| Topological Polar Surface Area | 78.03 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 293.08005 |
| Heavy Atoms | 22 |
| Complexity | 840.8522 |
Chemical Identifiers
| CAS Number | 333327-63-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC(=CC=C3)[N+](=O)[O-])C=O |
Product Overview
3-(3-nitrophenyl)-1-phenyl-1H-pyrazole-4-carbaldehyde (CAS 333327-63-2), with molecular formula C16H11N3O3 and molecular weight 293.08 g/mol. IUPAC: 3-(3-nitrophenyl)-1-phenylpyrazole-4-carbaldehyde.
Chemical Property Profile of 3-(3-nitrophenyl)-1-phenyl-1H-pyrazole-4-carbaldehyde
Property Insights of 3-(3-nitrophenyl)-1-phenyl-1H-pyrazole-4-carbaldehyde
The XLogP value of 3.26 indicates that 3-(3-nitrophenyl)-1-phenyl-1H-pyrazole-4-carbaldehyde is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.03 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(3-nitrophenyl)-1-phenyl-1H-pyrazole-4-carbaldehyde. Following Lipinski's Rule of Five, 3-(3-nitrophenyl)-1-phenyl-1H-pyrazole-4-carbaldehyde 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 3-(3-nitrophenyl)-1-phenyl-1H-pyrazole-4-carbaldehyde?
The CAS number of 3-(3-nitrophenyl)-1-phenyl-1H-pyrazole-4-carbaldehyde is 333327-63-2.
What is the molecular formula of 3-(3-nitrophenyl)-1-phenyl-1H-pyrazole-4-carbaldehyde?
The molecular formula of 3-(3-nitrophenyl)-1-phenyl-1H-pyrazole-4-carbaldehyde is C16H11N3O3.
What is the molecular weight of 3-(3-nitrophenyl)-1-phenyl-1H-pyrazole-4-carbaldehyde?
The molecular weight of 3-(3-nitrophenyl)-1-phenyl-1H-pyrazole-4-carbaldehyde is 293.08 g/mol.
Where can I buy 3-(3-nitrophenyl)-1-phenyl-1H-pyrazole-4-carbaldehyde?
You can request a quote for 3-(3-nitrophenyl)-1-phenyl-1H-pyrazole-4-carbaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(3-nitrophenyl)-1-phenyl-1H-pyrazole-4-carbaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 3-(3-nitrophenyl)-1-phenyl-1H-pyrazole-4-carbaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.