3-oxo-N-(5-oxo-1-phenyl-4H-pyrazol-3-yl)butanamide
TL;DR: 3-oxo-N-(5-oxo-1-phenyl-4H-pyrazol-3-yl)butanamide (CAS 101195-95-3) is a chemical compound with molecular formula C13H13N3O3 and molecular weight 259.0957 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-oxo-N-(5-oxo-1-phenyl-4H-pyrazol-3-yl)butanamide
Also Known As: 3-oxo-N-(5-oxo-1-phenyl-4H-pyrazol-3-yl)butanamide, 3-oxo-N-(5-oxo-1-phenyl-4,5-dihydro-1H-pyrazol-3-yl)butanamide
Technical Specifications
| Molecular Formula | C13H13N3O3 |
| Molecular Weight | 259.0957 g/mol |
| XLogP | 1.0 |
| Topological Polar Surface Area (TPSA) | 78.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 259.0957 Da |
| Heavy Atoms | 19 |
| Complexity | 425.0 |
| SMILES | CC(=O)CC(=O)NC1=NN(C(=O)C1)C2=CC=CC=C2 |
| InChIKey | MNKBFSAKNVAWJG-UHFFFAOYSA-N |
Chemical Property Profile of 3-oxo-N-(5-oxo-1-phenyl-4H-pyrazol-3-yl)butanamide
Property Insights of 3-oxo-N-(5-oxo-1-phenyl-4H-pyrazol-3-yl)butanamide
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-oxo-N-(5-oxo-1-phenyl-4H-pyrazol-3-yl)butanamide. The TPSA of 78.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-oxo-N-(5-oxo-1-phenyl-4H-pyrazol-3-yl)butanamide. Following Lipinski's Rule of Five, 3-oxo-N-(5-oxo-1-phenyl-4H-pyrazol-3-yl)butanamide has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 3-oxo-N-(5-oxo-1-phenyl-4H-pyrazol-3-yl)butanamide?
The CAS number of 3-oxo-N-(5-oxo-1-phenyl-4H-pyrazol-3-yl)butanamide is 101195-95-3.
What is the molecular formula of 3-oxo-N-(5-oxo-1-phenyl-4H-pyrazol-3-yl)butanamide?
The molecular formula of 3-oxo-N-(5-oxo-1-phenyl-4H-pyrazol-3-yl)butanamide is C13H13N3O3.
What is the molecular weight of 3-oxo-N-(5-oxo-1-phenyl-4H-pyrazol-3-yl)butanamide?
The molecular weight of 3-oxo-N-(5-oxo-1-phenyl-4H-pyrazol-3-yl)butanamide is 259.0957 g/mol.
Where can I buy 3-oxo-N-(5-oxo-1-phenyl-4H-pyrazol-3-yl)butanamide?
You can request a quote for 3-oxo-N-(5-oxo-1-phenyl-4H-pyrazol-3-yl)butanamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-oxo-N-(5-oxo-1-phenyl-4H-pyrazol-3-yl)butanamide?
Yes, CoreyChem provides custom synthesis services for 3-oxo-N-(5-oxo-1-phenyl-4H-pyrazol-3-yl)butanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.