1H-pyrazole-4,5-dione 4-[N-(3-chlorophenyl)hydrazone]
TL;DR: 1H-pyrazole-4,5-dione 4-[N-(3-chlorophenyl)hydrazone] (CAS 338416-83-4) is a chemical compound with molecular formula C9H7ClN4O and molecular weight 222.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(3-chlorophenyl)diazenyl]-1,2-dihydropyrazol-3-one
Also Known As: 1H-pyrazole-4,5-dione 4-[N-(3-chlorophenyl)hydrazone], 4-[2-(3-chlorophenyl)hydrazino]pyrazol-3-one, 4B-076, (4Z)-4-[2-(3-chlorophenyl)hydrazin-1-ylidene]-4,5-dihydro-1H-pyrazol-5-one, 4-[2-(3-chlorophenyl)hydrazinyl]pyrazol-3-one
| Molecular Formula | C9H7ClN4O |
|---|---|
| Molecular Weight | 222.03 g/mol |
| LogP | 2.7718 |
| Topological Polar Surface Area | 73.37 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 222.03084 |
| Heavy Atoms | 15 |
| Complexity | 542.7954 |
Chemical Identifiers
| CAS Number | 338416-83-4 |
|---|---|
| SMILES | C1=CC(=CC(=C1)Cl)N=NC2=CNNC2=O |
Product Overview
1H-pyrazole-4,5-dione 4-[N-(3-chlorophenyl)hydrazone] (CAS 338416-83-4), with molecular formula C9H7ClN4O and molecular weight 222.03 g/mol. IUPAC: 4-[(3-chlorophenyl)diazenyl]-1,2-dihydropyrazol-3-one.
Chemical Property Profile of 1H-pyrazole-4,5-dione 4-[N-(3-chlorophenyl)hydrazone]
Property Insights of 1H-pyrazole-4,5-dione 4-[N-(3-chlorophenyl)hydrazone]
The XLogP value of 2.7718 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-pyrazole-4,5-dione 4-[N-(3-chlorophenyl)hydrazone]. The TPSA of 73.37 Ų falls within the moderate polarity range, balancing permeability and solubility for 1H-pyrazole-4,5-dione 4-[N-(3-chlorophenyl)hydrazone]. Following Lipinski's Rule of Five, 1H-pyrazole-4,5-dione 4-[N-(3-chlorophenyl)hydrazone] 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 1H-pyrazole-4,5-dione 4-[N-(3-chlorophenyl)hydrazone]?
The CAS number of 1H-pyrazole-4,5-dione 4-[N-(3-chlorophenyl)hydrazone] is 338416-83-4.
What is the molecular formula of 1H-pyrazole-4,5-dione 4-[N-(3-chlorophenyl)hydrazone]?
The molecular formula of 1H-pyrazole-4,5-dione 4-[N-(3-chlorophenyl)hydrazone] is C9H7ClN4O.
What is the molecular weight of 1H-pyrazole-4,5-dione 4-[N-(3-chlorophenyl)hydrazone]?
The molecular weight of 1H-pyrazole-4,5-dione 4-[N-(3-chlorophenyl)hydrazone] is 222.03 g/mol.
Where can I buy 1H-pyrazole-4,5-dione 4-[N-(3-chlorophenyl)hydrazone]?
You can request a quote for 1H-pyrazole-4,5-dione 4-[N-(3-chlorophenyl)hydrazone] directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-pyrazole-4,5-dione 4-[N-(3-chlorophenyl)hydrazone]?
Yes, KEHONG BIO provides custom synthesis services for 1H-pyrazole-4,5-dione 4-[N-(3-chlorophenyl)hydrazone] and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.