![N''-methyl-2-nitro-N'-{[3-oxo-2-benzofuran-1(3H)-yliden]methyl}ethanimidohydrazide structure](/static/products/320/320424-99-5.png)
N''-methyl-2-nitro-N'-{[3-oxo-2-benzofuran-1(3H)-yliden]methyl}ethanimidohydrazide
TL;DR: N''-methyl-2-nitro-N'-{[3-oxo-2-benzofuran-1(3H)-yliden]methyl}ethanimidohydrazide (CAS 320424-99-5) is a chemical compound with molecular formula C12H12N4O4 and molecular weight 276.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(3-hydroxy-2-benzofuran-1-yl)methylideneamino]-N'-methyl-2-nitroethanimidamide
Also Known As: N''-methyl-2-nitro-N'-{[3-oxo-2-benzofuran-1(3H)-yliden]methyl}ethanimidohydrazide
| Molecular Formula | C12H12N4O4 |
|---|---|
| Molecular Weight | 276.09 g/mol |
| LogP | 1.3669 |
| Topological Polar Surface Area | 113.26 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 276.08585 |
| Heavy Atoms | 20 |
| Complexity | 689.8222 |
Chemical Identifiers
| CAS Number | 320424-99-5 |
|---|---|
| SMILES | CN=C(C[N+](=O)[O-])NN=CC1=C2C=CC=CC2=C(O1)O |
Product Overview
N''-methyl-2-nitro-N'-{[3-oxo-2-benzofuran-1(3H)-yliden]methyl}ethanimidohydrazide (CAS 320424-99-5), with molecular formula C12H12N4O4 and molecular weight 276.09 g/mol. IUPAC: N-[(3-hydroxy-2-benzofuran-1-yl)methylideneamino]-N'-methyl-2-nitroethanimidamide.
Chemical Property Profile of N''-methyl-2-nitro-N'-{[3-oxo-2-benzofuran-1(3H)-yliden]methyl}ethanimidohydrazide
Property Insights of N''-methyl-2-nitro-N'-{[3-oxo-2-benzofuran-1(3H)-yliden]methyl}ethanimidohydrazide
The XLogP value of 1.3669 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N''-methyl-2-nitro-N'-{[3-oxo-2-benzofuran-1(3H)-yliden]methyl}ethanimidohydrazide. The TPSA of 113.26 Ų falls within the moderate polarity range, balancing permeability and solubility for N''-methyl-2-nitro-N'-{[3-oxo-2-benzofuran-1(3H)-yliden]methyl}ethanimidohydrazide. Following Lipinski's Rule of Five, N''-methyl-2-nitro-N'-{[3-oxo-2-benzofuran-1(3H)-yliden]methyl}ethanimidohydrazide has 2 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 N''-methyl-2-nitro-N'-{[3-oxo-2-benzofuran-1(3H)-yliden]methyl}ethanimidohydrazide?
The CAS number of N''-methyl-2-nitro-N'-{[3-oxo-2-benzofuran-1(3H)-yliden]methyl}ethanimidohydrazide is 320424-99-5.
What is the molecular formula of N''-methyl-2-nitro-N'-{[3-oxo-2-benzofuran-1(3H)-yliden]methyl}ethanimidohydrazide?
The molecular formula of N''-methyl-2-nitro-N'-{[3-oxo-2-benzofuran-1(3H)-yliden]methyl}ethanimidohydrazide is C12H12N4O4.
What is the molecular weight of N''-methyl-2-nitro-N'-{[3-oxo-2-benzofuran-1(3H)-yliden]methyl}ethanimidohydrazide?
The molecular weight of N''-methyl-2-nitro-N'-{[3-oxo-2-benzofuran-1(3H)-yliden]methyl}ethanimidohydrazide is 276.09 g/mol.
Where can I buy N''-methyl-2-nitro-N'-{[3-oxo-2-benzofuran-1(3H)-yliden]methyl}ethanimidohydrazide?
You can request a quote for N''-methyl-2-nitro-N'-{[3-oxo-2-benzofuran-1(3H)-yliden]methyl}ethanimidohydrazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N''-methyl-2-nitro-N'-{[3-oxo-2-benzofuran-1(3H)-yliden]methyl}ethanimidohydrazide?
Yes, KEHONG BIO provides custom synthesis services for N''-methyl-2-nitro-N'-{[3-oxo-2-benzofuran-1(3H)-yliden]methyl}ethanimidohydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.