![2-[(3-Methyl-5-oxo-4-pyrazolyl)hydrazo]benzonitrile structure](/static/products/328/328025-91-8.png)
2-[(3-Methyl-5-oxo-4-pyrazolyl)hydrazo]benzonitrile
TL;DR: 2-[(3-Methyl-5-oxo-4-pyrazolyl)hydrazo]benzonitrile (CAS 328025-91-8) is a chemical compound with molecular formula C11H9N5O and molecular weight 227.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(3-methyl-5-oxo-1,2-dihydropyrazol-4-yl)diazenyl]benzonitrile
Also Known As: 2-[(3-methyl-5-oxo-4-pyrazolyl)hydrazo]benzonitrile, 2-[2-(3-methyl-5-oxopyrazol-4-yl)hydrazinyl]benzonitrile, 2-[2-(3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene)hydrazino]benzonitrile, AN-329/40543634, 2-[(3-methyl-5-oxo-1,2-dihydropyrazol-4-yl)diazenyl]benzonitrile
| Molecular Formula | C11H9N5O |
|---|---|
| Molecular Weight | 227.08 g/mol |
| LogP | 2.2985 |
| Topological Polar Surface Area | 97.16 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 227.0807 |
| Heavy Atoms | 17 |
| Complexity | 658.9867 |
Chemical Identifiers
| CAS Number | 328025-91-8 |
|---|---|
| SMILES | CC1=C(C(=O)NN1)N=NC2=CC=CC=C2C#N |
Product Overview
2-[(3-Methyl-5-oxo-4-pyrazolyl)hydrazo]benzonitrile (CAS 328025-91-8), with molecular formula C11H9N5O and molecular weight 227.08 g/mol. IUPAC: 2-[(3-methyl-5-oxo-1,2-dihydropyrazol-4-yl)diazenyl]benzonitrile.
Chemical Property Profile of 2-[(3-Methyl-5-oxo-4-pyrazolyl)hydrazo]benzonitrile
Property Insights of 2-[(3-Methyl-5-oxo-4-pyrazolyl)hydrazo]benzonitrile
The XLogP value of 2.2985 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[(3-Methyl-5-oxo-4-pyrazolyl)hydrazo]benzonitrile. The TPSA of 97.16 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(3-Methyl-5-oxo-4-pyrazolyl)hydrazo]benzonitrile. Following Lipinski's Rule of Five, 2-[(3-Methyl-5-oxo-4-pyrazolyl)hydrazo]benzonitrile has 2 hydrogen bond donor(s) and 4 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 2-[(3-Methyl-5-oxo-4-pyrazolyl)hydrazo]benzonitrile?
The CAS number of 2-[(3-Methyl-5-oxo-4-pyrazolyl)hydrazo]benzonitrile is 328025-91-8.
What is the molecular formula of 2-[(3-Methyl-5-oxo-4-pyrazolyl)hydrazo]benzonitrile?
The molecular formula of 2-[(3-Methyl-5-oxo-4-pyrazolyl)hydrazo]benzonitrile is C11H9N5O.
What is the molecular weight of 2-[(3-Methyl-5-oxo-4-pyrazolyl)hydrazo]benzonitrile?
The molecular weight of 2-[(3-Methyl-5-oxo-4-pyrazolyl)hydrazo]benzonitrile is 227.08 g/mol.
Where can I buy 2-[(3-Methyl-5-oxo-4-pyrazolyl)hydrazo]benzonitrile?
You can request a quote for 2-[(3-Methyl-5-oxo-4-pyrazolyl)hydrazo]benzonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(3-Methyl-5-oxo-4-pyrazolyl)hydrazo]benzonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-[(3-Methyl-5-oxo-4-pyrazolyl)hydrazo]benzonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.