1-Methyl-2-(4-methylphenyl)sulfonyl-1-nitrosoguanidine
TL;DR: 1-Methyl-2-(4-methylphenyl)sulfonyl-1-nitrosoguanidine (CAS 189556-52-3) is a chemical compound with molecular formula C9H12N4O3S and molecular weight 256.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methyl-2-(4-methylphenyl)sulfonyl-1-nitrosoguanidine
Also Known As: Nitroso toluenesulphonylguanidine, 1-methyl-2-(4-methylphenyl)sulfonyl-1-nitrosoguanidine, Benzenesulfonamide, N-[imino(methylnitrosoamino)methyl]-4-methyl-, N-{Amino[methyl(nitroso)amino]methylidene}-4-methylbenzene-1-sulfonamide
| Molecular Formula | C9H12N4O3S |
|---|---|
| Molecular Weight | 256.06 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 114.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 256.06302 |
| Heavy Atoms | 17 |
| Complexity | 393.0 |
Chemical Identifiers
| CAS Number | 189556-52-3 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)N=C(N)N(C)N=O |
| InChIKey | DZZBAEAONUJMBD-UHFFFAOYSA-N |
Product Overview
1-Methyl-2-(4-methylphenyl)sulfonyl-1-nitrosoguanidine (CAS 189556-52-3), with molecular formula C9H12N4O3S and molecular weight 256.06 g/mol. IUPAC: 1-methyl-2-(4-methylphenyl)sulfonyl-1-nitrosoguanidine.
Chemical Property Profile of 1-Methyl-2-(4-methylphenyl)sulfonyl-1-nitrosoguanidine
Property Insights of 1-Methyl-2-(4-methylphenyl)sulfonyl-1-nitrosoguanidine
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Methyl-2-(4-methylphenyl)sulfonyl-1-nitrosoguanidine. The TPSA of 114.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Methyl-2-(4-methylphenyl)sulfonyl-1-nitrosoguanidine. Following Lipinski's Rule of Five, 1-Methyl-2-(4-methylphenyl)sulfonyl-1-nitrosoguanidine has 1 hydrogen bond donor(s) and 5 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 1-Methyl-2-(4-methylphenyl)sulfonyl-1-nitrosoguanidine?
The CAS number of 1-Methyl-2-(4-methylphenyl)sulfonyl-1-nitrosoguanidine is 189556-52-3.
What is the molecular formula of 1-Methyl-2-(4-methylphenyl)sulfonyl-1-nitrosoguanidine?
The molecular formula of 1-Methyl-2-(4-methylphenyl)sulfonyl-1-nitrosoguanidine is C9H12N4O3S.
What is the molecular weight of 1-Methyl-2-(4-methylphenyl)sulfonyl-1-nitrosoguanidine?
The molecular weight of 1-Methyl-2-(4-methylphenyl)sulfonyl-1-nitrosoguanidine is 256.06 g/mol.
Where can I buy 1-Methyl-2-(4-methylphenyl)sulfonyl-1-nitrosoguanidine?
You can request a quote for 1-Methyl-2-(4-methylphenyl)sulfonyl-1-nitrosoguanidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Methyl-2-(4-methylphenyl)sulfonyl-1-nitrosoguanidine?
Yes, KEHONG BIO provides custom synthesis services for 1-Methyl-2-(4-methylphenyl)sulfonyl-1-nitrosoguanidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.