s-Triazole, 5-(N-methyl-N-nitroso)amino-3-(5-nitro-2-furyl)-
TL;DR: s-Triazole, 5-(N-methyl-N-nitroso)amino-3-(5-nitro-2-furyl)- (CAS 41735-28-8) is a chemical compound with molecular formula C7H6N6O4 and molecular weight 238.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-methyl-N-[5-(5-nitrofuran-2-yl)-1H-1,2,4-triazol-3-yl]nitrous amide
Also Known As: s-Triazole, 5-(N-methyl-N-nitroso)amino-3-(5-nitro-2-furyl)-, Methylamine, N-(3-(5-nitro-2-furyl)-s-triazol-5-yl)-N-nitroso-, 1H-1,2,4-Triazol-5-amine, N-methyl-3-(5-nitro-2-furyl)-N-nitroso-, N-methyl-N-[5-(5-nitrofuran-2-yl)-1H-1,2,4-triazol-3-yl]nitrous amide, 1H-1,2,4-Triazol-5-amine,N-methyl-3-(5-nitro-2-furyl)-N-nitroso
| Molecular Formula | C7H6N6O4 |
|---|---|
| Molecular Weight | 238.05 g/mol |
| LogP | 1.0905 |
| Topological Polar Surface Area | 130.52 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 238.04506 |
| Heavy Atoms | 17 |
| Complexity | 560.21985 |
Chemical Identifiers
| CAS Number | 41735-28-8 |
|---|---|
| SMILES | CN(C1=NNC(=N1)C2=CC=C(O2)[N+](=O)[O-])N=O |
Product Overview
s-Triazole, 5-(N-methyl-N-nitroso)amino-3-(5-nitro-2-furyl)- (CAS 41735-28-8), with molecular formula C7H6N6O4 and molecular weight 238.05 g/mol. IUPAC: N-methyl-N-[5-(5-nitrofuran-2-yl)-1H-1,2,4-triazol-3-yl]nitrous amide.
Chemical Property Profile of s-Triazole, 5-(N-methyl-N-nitroso)amino-3-(5-nitro-2-furyl)-
Property Insights of s-Triazole, 5-(N-methyl-N-nitroso)amino-3-(5-nitro-2-furyl)-
The XLogP value of 1.0905 suggests moderate lipophilicity, balancing water solubility and membrane permeability for s-Triazole, 5-(N-methyl-N-nitroso)amino-3-(5-nitro-2-furyl)-. The TPSA of 130.52 Ų falls within the moderate polarity range, balancing permeability and solubility for s-Triazole, 5-(N-methyl-N-nitroso)amino-3-(5-nitro-2-furyl)-. Following Lipinski's Rule of Five, s-Triazole, 5-(N-methyl-N-nitroso)amino-3-(5-nitro-2-furyl)- has 1 hydrogen bond donor(s) and 7 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 s-Triazole, 5-(N-methyl-N-nitroso)amino-3-(5-nitro-2-furyl)-?
The CAS number of s-Triazole, 5-(N-methyl-N-nitroso)amino-3-(5-nitro-2-furyl)- is 41735-28-8.
What is the molecular formula of s-Triazole, 5-(N-methyl-N-nitroso)amino-3-(5-nitro-2-furyl)-?
The molecular formula of s-Triazole, 5-(N-methyl-N-nitroso)amino-3-(5-nitro-2-furyl)- is C7H6N6O4.
What is the molecular weight of s-Triazole, 5-(N-methyl-N-nitroso)amino-3-(5-nitro-2-furyl)-?
The molecular weight of s-Triazole, 5-(N-methyl-N-nitroso)amino-3-(5-nitro-2-furyl)- is 238.05 g/mol.
Where can I buy s-Triazole, 5-(N-methyl-N-nitroso)amino-3-(5-nitro-2-furyl)-?
You can request a quote for s-Triazole, 5-(N-methyl-N-nitroso)amino-3-(5-nitro-2-furyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for s-Triazole, 5-(N-methyl-N-nitroso)amino-3-(5-nitro-2-furyl)-?
Yes, KEHONG BIO provides custom synthesis services for s-Triazole, 5-(N-methyl-N-nitroso)amino-3-(5-nitro-2-furyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.