3-Pyrazolin-5-one, 2-acetyl-3-phenyl-
TL;DR: 3-Pyrazolin-5-one, 2-acetyl-3-phenyl- (CAS 24768-95-4) is a chemical compound with molecular formula C11H10N2O2 and molecular weight 202.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-acetyl-3-phenyl-1H-pyrazol-5-one
Also Known As: 3-Pyrazolin-5-one, 2-acetyl-3-phenyl-, 2-acetyl-3-phenyl-1H-pyrazol-5-one, 2-Acetyl-3-phenyl-3-pyrazolin-5-one, 1-acetyl-5-phenyl-1H-pyrazol-3(2H)-one, 1-Acetyl-5-phenyl-1,2-dihydro-3H-pyrazol-3-one
| Molecular Formula | C11H10N2O2 |
|---|---|
| Molecular Weight | 202.07 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 49.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 202.07423 |
| Heavy Atoms | 15 |
| Complexity | 317.0 |
Chemical Identifiers
| CAS Number | 24768-95-4 |
|---|---|
| SMILES | CC(=O)N1C(=CC(=O)N1)C2=CC=CC=C2 |
| InChIKey | XDIORIXOLJTLDJ-UHFFFAOYSA-N |
Product Overview
3-Pyrazolin-5-one, 2-acetyl-3-phenyl- (CAS 24768-95-4), with molecular formula C11H10N2O2 and molecular weight 202.07 g/mol. IUPAC: 2-acetyl-3-phenyl-1H-pyrazol-5-one.
Chemical Property Profile of 3-Pyrazolin-5-one, 2-acetyl-3-phenyl-
Property Insights of 3-Pyrazolin-5-one, 2-acetyl-3-phenyl-
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Pyrazolin-5-one, 2-acetyl-3-phenyl-. With a topological polar surface area (TPSA) of 49.4 Ų, 3-Pyrazolin-5-one, 2-acetyl-3-phenyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Pyrazolin-5-one, 2-acetyl-3-phenyl- has 1 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 3-Pyrazolin-5-one, 2-acetyl-3-phenyl-?
The CAS number of 3-Pyrazolin-5-one, 2-acetyl-3-phenyl- is 24768-95-4.
What is the molecular formula of 3-Pyrazolin-5-one, 2-acetyl-3-phenyl-?
The molecular formula of 3-Pyrazolin-5-one, 2-acetyl-3-phenyl- is C11H10N2O2.
What is the molecular weight of 3-Pyrazolin-5-one, 2-acetyl-3-phenyl-?
The molecular weight of 3-Pyrazolin-5-one, 2-acetyl-3-phenyl- is 202.07 g/mol.
Where can I buy 3-Pyrazolin-5-one, 2-acetyl-3-phenyl-?
You can request a quote for 3-Pyrazolin-5-one, 2-acetyl-3-phenyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Pyrazolin-5-one, 2-acetyl-3-phenyl-?
Yes, KEHONG BIO provides custom synthesis services for 3-Pyrazolin-5-one, 2-acetyl-3-phenyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.