N-methyl-4-nitro-N-(2,4,6-triaminopyrimidin-5-yl)benzenesulfonamide
TL;DR: N-methyl-4-nitro-N-(2,4,6-triaminopyrimidin-5-yl)benzenesulfonamide (CAS 86764-08-1) is a chemical compound with molecular formula C11H13N7O4S and molecular weight 339.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-methyl-4-nitro-N-(2,4,6-triaminopyrimidin-5-yl)benzenesulfonamide
Also Known As: N-methyl-4-nitro-N-(2,4,6-triaminopyrimidin-5-yl)benzenesulfonamide, N-methyl-4-nitro-N-(2,4,6-triaminopyrimidin-5-yl)benzenesulf, N-Methyl-4-nitro-N-(2,4,6-triaminopyrimidin-5-yl)benzene-1-sulfonamide
| Molecular Formula | C11H13N7O4S |
|---|---|
| Molecular Weight | 339.07 g/mol |
| LogP | -0.3 |
| Topological Polar Surface Area | 195.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 3 |
| Exact Mass | 339.07498 |
| Heavy Atoms | 23 |
| Complexity | 513.0 |
Chemical Identifiers
| CAS Number | 86764-08-1 |
|---|---|
| SMILES | CN(C1=C(N=C(N=C1N)N)N)S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-] |
| InChIKey | OBMNDZGSSSNEHT-UHFFFAOYSA-N |
Product Overview
N-methyl-4-nitro-N-(2,4,6-triaminopyrimidin-5-yl)benzenesulfonamide (CAS 86764-08-1), with molecular formula C11H13N7O4S and molecular weight 339.07 g/mol. IUPAC: N-methyl-4-nitro-N-(2,4,6-triaminopyrimidin-5-yl)benzenesulfonamide.
Chemical Property Profile of N-methyl-4-nitro-N-(2,4,6-triaminopyrimidin-5-yl)benzenesulfonamide
Property Insights of N-methyl-4-nitro-N-(2,4,6-triaminopyrimidin-5-yl)benzenesulfonamide
The XLogP value of -0.3 indicates that N-methyl-4-nitro-N-(2,4,6-triaminopyrimidin-5-yl)benzenesulfonamide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 195.0 Ų indicates high polarity, suggesting N-methyl-4-nitro-N-(2,4,6-triaminopyrimidin-5-yl)benzenesulfonamide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, N-methyl-4-nitro-N-(2,4,6-triaminopyrimidin-5-yl)benzenesulfonamide has 3 hydrogen bond donor(s) and 10 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-4-nitro-N-(2,4,6-triaminopyrimidin-5-yl)benzenesulfonamide?
The CAS number of N-methyl-4-nitro-N-(2,4,6-triaminopyrimidin-5-yl)benzenesulfonamide is 86764-08-1.
What is the molecular formula of N-methyl-4-nitro-N-(2,4,6-triaminopyrimidin-5-yl)benzenesulfonamide?
The molecular formula of N-methyl-4-nitro-N-(2,4,6-triaminopyrimidin-5-yl)benzenesulfonamide is C11H13N7O4S.
What is the molecular weight of N-methyl-4-nitro-N-(2,4,6-triaminopyrimidin-5-yl)benzenesulfonamide?
The molecular weight of N-methyl-4-nitro-N-(2,4,6-triaminopyrimidin-5-yl)benzenesulfonamide is 339.07 g/mol.
Where can I buy N-methyl-4-nitro-N-(2,4,6-triaminopyrimidin-5-yl)benzenesulfonamide?
You can request a quote for N-methyl-4-nitro-N-(2,4,6-triaminopyrimidin-5-yl)benzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-methyl-4-nitro-N-(2,4,6-triaminopyrimidin-5-yl)benzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for N-methyl-4-nitro-N-(2,4,6-triaminopyrimidin-5-yl)benzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.