4-oxo-4H,5H,6H,7H,8H-pyrazolo(1,5-a)(1,4)diazepine-2-carboxylic acid
TL;DR: 4-oxo-4H,5H,6H,7H,8H-pyrazolo(1,5-a)(1,4)diazepine-2-carboxylic acid (CAS 477863-08-4) is a chemical compound with molecular formula C8H9N3O3 and molecular weight 195.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-oxo-5,6,7,8-tetrahydropyrazolo[1,5-a][1,4]diazepine-2-carboxylic acid
Also Known As: 4-oxo-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carboxylic acid, 4-oxo-4H,5H,6H,7H,8H-pyrazolo[1,5-a][1,4]diazepine-2-carboxylic acid, 2-fluoro[1,1'-biphenyl]-4-ol, 4-oxo-5,6,7,8-tetrahydropyrazolo[1,5-a][1,4]diazepine-2-carboxylic acid, 4-oxo-4H,5H,6H,7H,8H-pyrazolo(1,5-a)(1,4)diazepine-2-carboxylic acid
| Molecular Formula | C8H9N3O3 |
|---|---|
| Molecular Weight | 195.06 g/mol |
| LogP | -0.2852 |
| Topological Polar Surface Area | 84.22 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 195.06439 |
| Heavy Atoms | 14 |
| Complexity | 396.5358 |
Chemical Identifiers
| CAS Number | 477863-08-4 |
|---|---|
| SMILES | C1CNC(=O)C2=CC(=NN2C1)C(=O)O |
Product Overview
4-oxo-4H,5H,6H,7H,8H-pyrazolo(1,5-a)(1,4)diazepine-2-carboxylic acid (CAS 477863-08-4), with molecular formula C8H9N3O3 and molecular weight 195.06 g/mol. IUPAC: 4-oxo-5,6,7,8-tetrahydropyrazolo[1,5-a][1,4]diazepine-2-carboxylic acid.
Chemical Property Profile of 4-oxo-4H,5H,6H,7H,8H-pyrazolo(1,5-a)(1,4)diazepine-2-carboxylic acid
Property Insights of 4-oxo-4H,5H,6H,7H,8H-pyrazolo(1,5-a)(1,4)diazepine-2-carboxylic acid
The XLogP value of -0.2852 indicates that 4-oxo-4H,5H,6H,7H,8H-pyrazolo(1,5-a)(1,4)diazepine-2-carboxylic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 84.22 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-oxo-4H,5H,6H,7H,8H-pyrazolo(1,5-a)(1,4)diazepine-2-carboxylic acid. Following Lipinski's Rule of Five, 4-oxo-4H,5H,6H,7H,8H-pyrazolo(1,5-a)(1,4)diazepine-2-carboxylic acid has 2 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 4-oxo-4H,5H,6H,7H,8H-pyrazolo(1,5-a)(1,4)diazepine-2-carboxylic acid?
The CAS number of 4-oxo-4H,5H,6H,7H,8H-pyrazolo(1,5-a)(1,4)diazepine-2-carboxylic acid is 477863-08-4.
What is the molecular formula of 4-oxo-4H,5H,6H,7H,8H-pyrazolo(1,5-a)(1,4)diazepine-2-carboxylic acid?
The molecular formula of 4-oxo-4H,5H,6H,7H,8H-pyrazolo(1,5-a)(1,4)diazepine-2-carboxylic acid is C8H9N3O3.
What is the molecular weight of 4-oxo-4H,5H,6H,7H,8H-pyrazolo(1,5-a)(1,4)diazepine-2-carboxylic acid?
The molecular weight of 4-oxo-4H,5H,6H,7H,8H-pyrazolo(1,5-a)(1,4)diazepine-2-carboxylic acid is 195.06 g/mol.
Where can I buy 4-oxo-4H,5H,6H,7H,8H-pyrazolo(1,5-a)(1,4)diazepine-2-carboxylic acid?
You can request a quote for 4-oxo-4H,5H,6H,7H,8H-pyrazolo(1,5-a)(1,4)diazepine-2-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-oxo-4H,5H,6H,7H,8H-pyrazolo(1,5-a)(1,4)diazepine-2-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-oxo-4H,5H,6H,7H,8H-pyrazolo(1,5-a)(1,4)diazepine-2-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.