1,4-Dihydro-N,1-dimethyl-6-(methylthio)-3,5-dinitro-2-pyridinamine
TL;DR: 1,4-Dihydro-N,1-dimethyl-6-(methylthio)-3,5-dinitro-2-pyridinamine (CAS 338777-80-3) is a chemical compound with molecular formula C8H12N4O4S and molecular weight 260.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,1-dimethyl-6-methylsulfanyl-3,5-dinitro-4H-pyridin-2-amine
Also Known As: N,1-dimethyl-6-(methylsulfanyl)-3,5-dinitro-1,4-dihydro-2-pyridinamine, N,1-dimethyl-6-(methylsulfanyl)-3,5-dinitro-1,4-dihydropyridin-2-amine, N,1-dimethyl-6-methylsulfanyl-3,5-dinitro-4H-pyridin-2-amine, 1,4-Dihydro-N,1-dimethyl-6-(methylthio)-3,5-dinitro-2-pyridinamine, RefChem:220556
| Molecular Formula | C8H12N4O4S |
|---|---|
| Molecular Weight | 260.06 g/mol |
| LogP | 0.7959 |
| Topological Polar Surface Area | 101.55 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 260.05792 |
| Heavy Atoms | 17 |
| Complexity | 393.24112 |
Chemical Identifiers
| CAS Number | 338777-80-3 |
|---|---|
| SMILES | CNC1=C(CC(=C(N1C)SC)[N+](=O)[O-])[N+](=O)[O-] |
Product Overview
1,4-Dihydro-N,1-dimethyl-6-(methylthio)-3,5-dinitro-2-pyridinamine (CAS 338777-80-3), with molecular formula C8H12N4O4S and molecular weight 260.06 g/mol. IUPAC: N,1-dimethyl-6-methylsulfanyl-3,5-dinitro-4H-pyridin-2-amine.
Chemical Property Profile of 1,4-Dihydro-N,1-dimethyl-6-(methylthio)-3,5-dinitro-2-pyridinamine
Property Insights of 1,4-Dihydro-N,1-dimethyl-6-(methylthio)-3,5-dinitro-2-pyridinamine
The XLogP value of 0.7959 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,4-Dihydro-N,1-dimethyl-6-(methylthio)-3,5-dinitro-2-pyridinamine. The TPSA of 101.55 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,4-Dihydro-N,1-dimethyl-6-(methylthio)-3,5-dinitro-2-pyridinamine. Following Lipinski's Rule of Five, 1,4-Dihydro-N,1-dimethyl-6-(methylthio)-3,5-dinitro-2-pyridinamine 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 1,4-Dihydro-N,1-dimethyl-6-(methylthio)-3,5-dinitro-2-pyridinamine?
The CAS number of 1,4-Dihydro-N,1-dimethyl-6-(methylthio)-3,5-dinitro-2-pyridinamine is 338777-80-3.
What is the molecular formula of 1,4-Dihydro-N,1-dimethyl-6-(methylthio)-3,5-dinitro-2-pyridinamine?
The molecular formula of 1,4-Dihydro-N,1-dimethyl-6-(methylthio)-3,5-dinitro-2-pyridinamine is C8H12N4O4S.
What is the molecular weight of 1,4-Dihydro-N,1-dimethyl-6-(methylthio)-3,5-dinitro-2-pyridinamine?
The molecular weight of 1,4-Dihydro-N,1-dimethyl-6-(methylthio)-3,5-dinitro-2-pyridinamine is 260.06 g/mol.
Where can I buy 1,4-Dihydro-N,1-dimethyl-6-(methylthio)-3,5-dinitro-2-pyridinamine?
You can request a quote for 1,4-Dihydro-N,1-dimethyl-6-(methylthio)-3,5-dinitro-2-pyridinamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,4-Dihydro-N,1-dimethyl-6-(methylthio)-3,5-dinitro-2-pyridinamine?
Yes, KEHONG BIO provides custom synthesis services for 1,4-Dihydro-N,1-dimethyl-6-(methylthio)-3,5-dinitro-2-pyridinamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.