![3-Methyl-4,5-isoxazoledione 4-[(4-nitrophenyl)hydrazone] structure](/static/products/174/1747-31-5.png)
3-Methyl-4,5-isoxazoledione 4-[(4-nitrophenyl)hydrazone]
TL;DR: 3-Methyl-4,5-isoxazoledione 4-[(4-nitrophenyl)hydrazone] (CAS 1747-31-5) is a chemical compound with molecular formula C10H8N4O4 and molecular weight 248.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methyl-4-[(4-nitrophenyl)diazenyl]-2H-1,2-oxazol-5-one
Also Known As: BIM-0011458.P001, J3.544.020H, 3-methyl-4,5-isoxazoledione 4-[(4-nitrophenyl)hydrazone], 3-methyl-4-[(4-nitrophenyl)hydrazinylidene]-1,2-oxazol-5-one, 3-methyl-isoxazole-4,5-dione 4-[(4-nitro-phenyl)-hydrazone]
| Molecular Formula | C10H8N4O4 |
|---|---|
| Molecular Weight | 248.05 g/mol |
| LogP | 2.59992 |
| Topological Polar Surface Area | 113.86 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 248.05455 |
| Heavy Atoms | 18 |
| Complexity | 653.2623 |
Chemical Identifiers
| CAS Number | 1747-31-5 |
|---|---|
| SMILES | CC1=C(C(=O)ON1)N=NC2=CC=C(C=C2)[N+](=O)[O-] |
Product Overview
3-Methyl-4,5-isoxazoledione 4-[(4-nitrophenyl)hydrazone] (CAS 1747-31-5), with molecular formula C10H8N4O4 and molecular weight 248.05 g/mol. IUPAC: 3-methyl-4-[(4-nitrophenyl)diazenyl]-2H-1,2-oxazol-5-one.
Chemical Property Profile of 3-Methyl-4,5-isoxazoledione 4-[(4-nitrophenyl)hydrazone]
Property Insights of 3-Methyl-4,5-isoxazoledione 4-[(4-nitrophenyl)hydrazone]
The XLogP value of 2.59992 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Methyl-4,5-isoxazoledione 4-[(4-nitrophenyl)hydrazone]. The TPSA of 113.86 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Methyl-4,5-isoxazoledione 4-[(4-nitrophenyl)hydrazone]. Following Lipinski's Rule of Five, 3-Methyl-4,5-isoxazoledione 4-[(4-nitrophenyl)hydrazone] has 1 hydrogen bond donor(s) and 6 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-Methyl-4,5-isoxazoledione 4-[(4-nitrophenyl)hydrazone]?
The CAS number of 3-Methyl-4,5-isoxazoledione 4-[(4-nitrophenyl)hydrazone] is 1747-31-5.
What is the molecular formula of 3-Methyl-4,5-isoxazoledione 4-[(4-nitrophenyl)hydrazone]?
The molecular formula of 3-Methyl-4,5-isoxazoledione 4-[(4-nitrophenyl)hydrazone] is C10H8N4O4.
What is the molecular weight of 3-Methyl-4,5-isoxazoledione 4-[(4-nitrophenyl)hydrazone]?
The molecular weight of 3-Methyl-4,5-isoxazoledione 4-[(4-nitrophenyl)hydrazone] is 248.05 g/mol.
Where can I buy 3-Methyl-4,5-isoxazoledione 4-[(4-nitrophenyl)hydrazone]?
You can request a quote for 3-Methyl-4,5-isoxazoledione 4-[(4-nitrophenyl)hydrazone] directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Methyl-4,5-isoxazoledione 4-[(4-nitrophenyl)hydrazone]?
Yes, KEHONG BIO provides custom synthesis services for 3-Methyl-4,5-isoxazoledione 4-[(4-nitrophenyl)hydrazone] and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.