1,3,5-Triphenylpyrazole-4-carbaldehyde
TL;DR: 1,3,5-Triphenylpyrazole-4-carbaldehyde (CAS 68426-71-1) is a chemical compound with molecular formula C22H16N2O and molecular weight 324.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3,5-triphenylpyrazole-4-carbaldehyde
Also Known As: 1,3,5-triphenyl-pyrazol-4-aldehyde, 1,3,5-triphenylpyrazole-4-carbaldehyde, 1H-Pyrazole-4-carboxaldehyde, 1,3,5-triphenyl-, 1,3,5-Triphenyl-1H-pyrazole-4-carbaldehyde
| Molecular Formula | C22H16N2O |
|---|---|
| Molecular Weight | 324.13 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 34.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 324.12625 |
| Heavy Atoms | 25 |
| Complexity | 422.0 |
Chemical Identifiers
| CAS Number | 68426-71-1 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=C(C(=NN2C3=CC=CC=C3)C4=CC=CC=C4)C=O |
| InChIKey | NWPWGORXCFKYJH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,3,5-Triphenylpyrazole-4-carbaldehyde (CAS 68426-71-1), with molecular formula C22H16N2O and molecular weight 324.13 g/mol. IUPAC: 1,3,5-triphenylpyrazole-4-carbaldehyde.
Chemical Property Profile of 1,3,5-Triphenylpyrazole-4-carbaldehyde
Property Insights of 1,3,5-Triphenylpyrazole-4-carbaldehyde
The XLogP value of 4.7 indicates that 1,3,5-Triphenylpyrazole-4-carbaldehyde is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.9 Ų, 1,3,5-Triphenylpyrazole-4-carbaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3,5-Triphenylpyrazole-4-carbaldehyde has 0 hydrogen bond donor(s) and 2 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 1,3,5-Triphenylpyrazole-4-carbaldehyde?
The CAS number of 1,3,5-Triphenylpyrazole-4-carbaldehyde is 68426-71-1.
What is the molecular formula of 1,3,5-Triphenylpyrazole-4-carbaldehyde?
The molecular formula of 1,3,5-Triphenylpyrazole-4-carbaldehyde is C22H16N2O.
What is the molecular weight of 1,3,5-Triphenylpyrazole-4-carbaldehyde?
The molecular weight of 1,3,5-Triphenylpyrazole-4-carbaldehyde is 324.13 g/mol.
Where can I buy 1,3,5-Triphenylpyrazole-4-carbaldehyde?
You can request a quote for 1,3,5-Triphenylpyrazole-4-carbaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3,5-Triphenylpyrazole-4-carbaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 1,3,5-Triphenylpyrazole-4-carbaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.