![[2-[N-[2-(3,5-dimethyl-4-nitropyrazol-1-yl)propanoylamino]-C-methylcarbonimidoyl]phenyl] furan-2-carboxylate structure](/static/products/606/606485-48-7.png)
[2-[N-[2-(3,5-dimethyl-4-nitropyrazol-1-yl)propanoylamino]-C-methylcarbonimidoyl]phenyl] furan-2-carboxylate
TL;DR: [2-[N-[2-(3,5-dimethyl-4-nitropyrazol-1-yl)propanoylamino]-C-methylcarbonimidoyl]phenyl] furan-2-carboxylate (CAS 606485-48-7) is a chemical compound with molecular formula C21H21N5O6 and molecular weight 439.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-[N-[2-(3,5-dimethyl-4-nitropyrazol-1-yl)propanoylamino]-C-methylcarbonimidoyl]phenyl] furan-2-carboxylate
Also Known As: [2-[N-[2-(3,5-dimethyl-4-nitropyrazol-1-yl)propanoylamino]-C-methylcarbonimidoyl]phenyl] furan-2-carboxylate|1H-Pyrazole-1-acetic acid, alpha,3,5-trimethyl-4-nitro-, [1-[2-[(2-furanylcarbonyl)oxy]phenyl]ethylidene]hydrazide (9CI)
| Molecular Formula | C21H21N5O6 |
|---|---|
| Molecular Weight | 439.15 g/mol |
| LogP | 3.32174 |
| Topological Polar Surface Area | 141.86 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 439.14917 |
| Heavy Atoms | 32 |
| Complexity | 1195.4933 |
Chemical Identifiers
| CAS Number | 606485-48-7 |
|---|---|
| SMILES | CC1=C(C(=NN1C(C)C(=O)NN=C(C)C2=CC=CC=C2OC(=O)C3=CC=CO3)C)[N+](=O)[O-] |
Product Overview
[2-[N-[2-(3,5-dimethyl-4-nitropyrazol-1-yl)propanoylamino]-C-methylcarbonimidoyl]phenyl] furan-2-carboxylate (CAS 606485-48-7), with molecular formula C21H21N5O6 and molecular weight 439.15 g/mol. IUPAC: [2-[N-[2-(3,5-dimethyl-4-nitropyrazol-1-yl)propanoylamino]-C-methylcarbonimidoyl]phenyl] furan-2-carboxylate.
Chemical Property Profile of [2-[N-[2-(3,5-dimethyl-4-nitropyrazol-1-yl)propanoylamino]-C-methylcarbonimidoyl]phenyl] furan-2-carboxylate
Property Insights of [2-[N-[2-(3,5-dimethyl-4-nitropyrazol-1-yl)propanoylamino]-C-methylcarbonimidoyl]phenyl] furan-2-carboxylate
The XLogP value of 3.32174 indicates that [2-[N-[2-(3,5-dimethyl-4-nitropyrazol-1-yl)propanoylamino]-C-methylcarbonimidoyl]phenyl] furan-2-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 141.86 Ų indicates high polarity, suggesting [2-[N-[2-(3,5-dimethyl-4-nitropyrazol-1-yl)propanoylamino]-C-methylcarbonimidoyl]phenyl] furan-2-carboxylate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, [2-[N-[2-(3,5-dimethyl-4-nitropyrazol-1-yl)propanoylamino]-C-methylcarbonimidoyl]phenyl] furan-2-carboxylate has 1 hydrogen bond donor(s) and 8 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-[N-[2-(3,5-dimethyl-4-nitropyrazol-1-yl)propanoylamino]-C-methylcarbonimidoyl]phenyl] furan-2-carboxylate?
The CAS number of [2-[N-[2-(3,5-dimethyl-4-nitropyrazol-1-yl)propanoylamino]-C-methylcarbonimidoyl]phenyl] furan-2-carboxylate is 606485-48-7.
What is the molecular formula of [2-[N-[2-(3,5-dimethyl-4-nitropyrazol-1-yl)propanoylamino]-C-methylcarbonimidoyl]phenyl] furan-2-carboxylate?
The molecular formula of [2-[N-[2-(3,5-dimethyl-4-nitropyrazol-1-yl)propanoylamino]-C-methylcarbonimidoyl]phenyl] furan-2-carboxylate is C21H21N5O6.
What is the molecular weight of [2-[N-[2-(3,5-dimethyl-4-nitropyrazol-1-yl)propanoylamino]-C-methylcarbonimidoyl]phenyl] furan-2-carboxylate?
The molecular weight of [2-[N-[2-(3,5-dimethyl-4-nitropyrazol-1-yl)propanoylamino]-C-methylcarbonimidoyl]phenyl] furan-2-carboxylate is 439.15 g/mol.
Where can I buy [2-[N-[2-(3,5-dimethyl-4-nitropyrazol-1-yl)propanoylamino]-C-methylcarbonimidoyl]phenyl] furan-2-carboxylate?
You can request a quote for [2-[N-[2-(3,5-dimethyl-4-nitropyrazol-1-yl)propanoylamino]-C-methylcarbonimidoyl]phenyl] furan-2-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [2-[N-[2-(3,5-dimethyl-4-nitropyrazol-1-yl)propanoylamino]-C-methylcarbonimidoyl]phenyl] furan-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for [2-[N-[2-(3,5-dimethyl-4-nitropyrazol-1-yl)propanoylamino]-C-methylcarbonimidoyl]phenyl] furan-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.