5-Oxo-1,3-diphenyl-4,5-dihydro-1H-pyrazole-4-carbaldehyde
TL;DR: 5-Oxo-1,3-diphenyl-4,5-dihydro-1H-pyrazole-4-carbaldehyde (CAS 17364-40-8) is a chemical compound with molecular formula C16H12N2O2 and molecular weight 264.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-oxo-1,3-diphenyl-4H-pyrazole-4-carbaldehyde
Also Known As: 1-Hexadecanoyllysolecithin, 1,3-Diphenyl-4-formyl-2-pyrazolin-5-one, 5-oxo-1,3-diphenyl-4H-pyrazole-4-carbaldehyde, 2-Pyrazolin-5-one, 1,3-diphenyl-4-formyl-, 5-oxo-1,3-diphenyl-4,5-dihydro-1H-pyrazole-4-carbaldehyde
| Molecular Formula | C16H12N2O2 |
|---|---|
| Molecular Weight | 264.09 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 49.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 264.08987 |
| Heavy Atoms | 20 |
| Complexity | 407.0 |
Chemical Identifiers
| CAS Number | 17364-40-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=NN(C(=O)C2C=O)C3=CC=CC=C3 |
| InChIKey | USUWCDUGDZBZMJ-UHFFFAOYSA-N |
Product Overview
5-Oxo-1,3-diphenyl-4,5-dihydro-1H-pyrazole-4-carbaldehyde (CAS 17364-40-8), with molecular formula C16H12N2O2 and molecular weight 264.09 g/mol. IUPAC: 5-oxo-1,3-diphenyl-4H-pyrazole-4-carbaldehyde.
Chemical Property Profile of 5-Oxo-1,3-diphenyl-4,5-dihydro-1H-pyrazole-4-carbaldehyde
Property Insights of 5-Oxo-1,3-diphenyl-4,5-dihydro-1H-pyrazole-4-carbaldehyde
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Oxo-1,3-diphenyl-4,5-dihydro-1H-pyrazole-4-carbaldehyde. With a topological polar surface area (TPSA) of 49.7 Ų, 5-Oxo-1,3-diphenyl-4,5-dihydro-1H-pyrazole-4-carbaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Oxo-1,3-diphenyl-4,5-dihydro-1H-pyrazole-4-carbaldehyde has 0 hydrogen bond donor(s) and 3 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 5-Oxo-1,3-diphenyl-4,5-dihydro-1H-pyrazole-4-carbaldehyde?
The CAS number of 5-Oxo-1,3-diphenyl-4,5-dihydro-1H-pyrazole-4-carbaldehyde is 17364-40-8.
What is the molecular formula of 5-Oxo-1,3-diphenyl-4,5-dihydro-1H-pyrazole-4-carbaldehyde?
The molecular formula of 5-Oxo-1,3-diphenyl-4,5-dihydro-1H-pyrazole-4-carbaldehyde is C16H12N2O2.
What is the molecular weight of 5-Oxo-1,3-diphenyl-4,5-dihydro-1H-pyrazole-4-carbaldehyde?
The molecular weight of 5-Oxo-1,3-diphenyl-4,5-dihydro-1H-pyrazole-4-carbaldehyde is 264.09 g/mol.
Where can I buy 5-Oxo-1,3-diphenyl-4,5-dihydro-1H-pyrazole-4-carbaldehyde?
You can request a quote for 5-Oxo-1,3-diphenyl-4,5-dihydro-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 5-Oxo-1,3-diphenyl-4,5-dihydro-1H-pyrazole-4-carbaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 5-Oxo-1,3-diphenyl-4,5-dihydro-1H-pyrazole-4-carbaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.