4-methyl-N-[(E)-(5-nitrofuran-2-yl)methylideneamino]benzenesulfonamide
TL;DR: 4-methyl-N-[(E)-(5-nitrofuran-2-yl)methylideneamino]benzenesulfonamide (CAS 13777-58-7) is a chemical compound with molecular formula C12H11N3O5S and molecular weight 309.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methyl-N-[(E)-(5-nitrofuran-2-yl)methylideneamino]benzenesulfonamide
Also Known As: 5-Nitro-2-furaldehyde p-tosylhydrazone, 4-methyl-N-[(E)-(5-nitrofuran-2-yl)methylideneamino]benzenesulfonamide, [(1E)-2-(5-nitro(2-furyl))-1-azavinyl][(4-methylphenyl)sulfonyl]amine, 4-Methyl-N'-[(E)-(5-nitro-2-furyl)methylidene]benzenesulfonohydrazide #, 4-methyl-N'-[(E)-(5-nitrofuran-2-yl)methylidene]benzenesulfonohydrazide
| Molecular Formula | C12H11N3O5S |
|---|---|
| Molecular Weight | 309.04 g/mol |
| LogP | 1.80862 |
| Topological Polar Surface Area | 114.81 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 309.04193 |
| Heavy Atoms | 21 |
| Complexity | 777.4792 |
Chemical Identifiers
| CAS Number | 13777-58-7 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)N/N=C/C2=CC=C(O2)[N+](=O)[O-] |
Product Overview
4-methyl-N-[(E)-(5-nitrofuran-2-yl)methylideneamino]benzenesulfonamide (CAS 13777-58-7), with molecular formula C12H11N3O5S and molecular weight 309.04 g/mol. IUPAC: 4-methyl-N-[(E)-(5-nitrofuran-2-yl)methylideneamino]benzenesulfonamide.
Chemical Property Profile of 4-methyl-N-[(E)-(5-nitrofuran-2-yl)methylideneamino]benzenesulfonamide
Property Insights of 4-methyl-N-[(E)-(5-nitrofuran-2-yl)methylideneamino]benzenesulfonamide
The XLogP value of 1.80862 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-methyl-N-[(E)-(5-nitrofuran-2-yl)methylideneamino]benzenesulfonamide. The TPSA of 114.81 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-methyl-N-[(E)-(5-nitrofuran-2-yl)methylideneamino]benzenesulfonamide. Following Lipinski's Rule of Five, 4-methyl-N-[(E)-(5-nitrofuran-2-yl)methylideneamino]benzenesulfonamide 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 4-methyl-N-[(E)-(5-nitrofuran-2-yl)methylideneamino]benzenesulfonamide?
The CAS number of 4-methyl-N-[(E)-(5-nitrofuran-2-yl)methylideneamino]benzenesulfonamide is 13777-58-7.
What is the molecular formula of 4-methyl-N-[(E)-(5-nitrofuran-2-yl)methylideneamino]benzenesulfonamide?
The molecular formula of 4-methyl-N-[(E)-(5-nitrofuran-2-yl)methylideneamino]benzenesulfonamide is C12H11N3O5S.
What is the molecular weight of 4-methyl-N-[(E)-(5-nitrofuran-2-yl)methylideneamino]benzenesulfonamide?
The molecular weight of 4-methyl-N-[(E)-(5-nitrofuran-2-yl)methylideneamino]benzenesulfonamide is 309.04 g/mol.
Where can I buy 4-methyl-N-[(E)-(5-nitrofuran-2-yl)methylideneamino]benzenesulfonamide?
You can request a quote for 4-methyl-N-[(E)-(5-nitrofuran-2-yl)methylideneamino]benzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-methyl-N-[(E)-(5-nitrofuran-2-yl)methylideneamino]benzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for 4-methyl-N-[(E)-(5-nitrofuran-2-yl)methylideneamino]benzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.