2-(2-Methylsulfanylethyl)-1-nitroguanidine
TL;DR: 2-(2-Methylsulfanylethyl)-1-nitroguanidine (CAS 6336-19-2) is a chemical compound with molecular formula C4H10N4O2S and molecular weight 178.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-methylsulfanylethyl)-1-nitroguanidine
Also Known As: 2-(2-methylsulfanylethyl)-1-nitroguanidine, 2-methyl-6-phenylpyridine-3-carbohydrazide, N''-[2-(Methylsulfanyl)ethyl]-N-nitroguanidine
| Molecular Formula | C4H10N4O2S |
|---|---|
| Molecular Weight | 178.05 g/mol |
| LogP | -0.1 |
| Topological Polar Surface Area | 122.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 178.05244 |
| Heavy Atoms | 11 |
| Complexity | 155.0 |
Chemical Identifiers
| CAS Number | 6336-19-2 |
|---|---|
| SMILES | CSCCN=C(N)N[N+](=O)[O-] |
| InChIKey | YUTXEKSZDOBMHQ-UHFFFAOYSA-N |
Product Overview
2-(2-Methylsulfanylethyl)-1-nitroguanidine (CAS 6336-19-2), with molecular formula C4H10N4O2S and molecular weight 178.05 g/mol. IUPAC: 2-(2-methylsulfanylethyl)-1-nitroguanidine.
Chemical Property Profile of 2-(2-Methylsulfanylethyl)-1-nitroguanidine
Property Insights of 2-(2-Methylsulfanylethyl)-1-nitroguanidine
The XLogP value of -0.1 indicates that 2-(2-Methylsulfanylethyl)-1-nitroguanidine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 122.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(2-Methylsulfanylethyl)-1-nitroguanidine. Following Lipinski's Rule of Five, 2-(2-Methylsulfanylethyl)-1-nitroguanidine has 2 hydrogen bond donor(s) and 4 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 2-(2-Methylsulfanylethyl)-1-nitroguanidine?
The CAS number of 2-(2-Methylsulfanylethyl)-1-nitroguanidine is 6336-19-2.
What is the molecular formula of 2-(2-Methylsulfanylethyl)-1-nitroguanidine?
The molecular formula of 2-(2-Methylsulfanylethyl)-1-nitroguanidine is C4H10N4O2S.
What is the molecular weight of 2-(2-Methylsulfanylethyl)-1-nitroguanidine?
The molecular weight of 2-(2-Methylsulfanylethyl)-1-nitroguanidine is 178.05 g/mol.
Where can I buy 2-(2-Methylsulfanylethyl)-1-nitroguanidine?
You can request a quote for 2-(2-Methylsulfanylethyl)-1-nitroguanidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2-Methylsulfanylethyl)-1-nitroguanidine?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-Methylsulfanylethyl)-1-nitroguanidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.