4-Methyl-6-(3-pyridylcarbonylthio)pyrimidin-2-ylthio 3-pyridyl ketone
TL;DR: 4-Methyl-6-(3-pyridylcarbonylthio)pyrimidin-2-ylthio 3-pyridyl ketone (CAS 6492-79-1) is a chemical compound with molecular formula C17H12N4O2S2 and molecular weight 368.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
S-[6-methyl-2-(pyridine-3-carbonylsulfanyl)pyrimidin-4-yl] pyridine-3-carbothioate
Also Known As: Diphenylamine, 4,4'-diamino-, dihydrochloride, 1,4-Benzenediamine, N-(4-aminophenyl)-, dihydrochloride, S,S'-(6-Methylpyrimidine-2,4-diyl) dipyridine-3-carbothioate, 4-methyl-6-(3-pyridylcarbonylthio)pyrimidin-2-ylthio 3-pyridyl ketone, [6-methyl-2-(pyridine-3-carbonylsulfanyl)pyrimidin-4-yl]sulfanyl-pyridin-3-yl-methanone
| Molecular Formula | C17H12N4O2S2 |
|---|---|
| Molecular Weight | 368.04 g/mol |
| LogP | 3.44002 |
| Topological Polar Surface Area | 85.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 368.04016 |
| Heavy Atoms | 25 |
| Complexity | 833.28613 |
Chemical Identifiers
| CAS Number | 6492-79-1 |
|---|---|
| SMILES | CC1=CC(=NC(=N1)SC(=O)C2=CN=CC=C2)SC(=O)C3=CN=CC=C3 |
Product Overview
4-Methyl-6-(3-pyridylcarbonylthio)pyrimidin-2-ylthio 3-pyridyl ketone (CAS 6492-79-1), with molecular formula C17H12N4O2S2 and molecular weight 368.04 g/mol. IUPAC: S-[6-methyl-2-(pyridine-3-carbonylsulfanyl)pyrimidin-4-yl] pyridine-3-carbothioate.
Chemical Property Profile of 4-Methyl-6-(3-pyridylcarbonylthio)pyrimidin-2-ylthio 3-pyridyl ketone
Property Insights of 4-Methyl-6-(3-pyridylcarbonylthio)pyrimidin-2-ylthio 3-pyridyl ketone
The XLogP value of 3.44002 indicates that 4-Methyl-6-(3-pyridylcarbonylthio)pyrimidin-2-ylthio 3-pyridyl ketone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Methyl-6-(3-pyridylcarbonylthio)pyrimidin-2-ylthio 3-pyridyl ketone. Following Lipinski's Rule of Five, 4-Methyl-6-(3-pyridylcarbonylthio)pyrimidin-2-ylthio 3-pyridyl ketone has 0 hydrogen bond donor(s) and 8 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 4-Methyl-6-(3-pyridylcarbonylthio)pyrimidin-2-ylthio 3-pyridyl ketone?
The CAS number of 4-Methyl-6-(3-pyridylcarbonylthio)pyrimidin-2-ylthio 3-pyridyl ketone is 6492-79-1.
What is the molecular formula of 4-Methyl-6-(3-pyridylcarbonylthio)pyrimidin-2-ylthio 3-pyridyl ketone?
The molecular formula of 4-Methyl-6-(3-pyridylcarbonylthio)pyrimidin-2-ylthio 3-pyridyl ketone is C17H12N4O2S2.
What is the molecular weight of 4-Methyl-6-(3-pyridylcarbonylthio)pyrimidin-2-ylthio 3-pyridyl ketone?
The molecular weight of 4-Methyl-6-(3-pyridylcarbonylthio)pyrimidin-2-ylthio 3-pyridyl ketone is 368.04 g/mol.
Where can I buy 4-Methyl-6-(3-pyridylcarbonylthio)pyrimidin-2-ylthio 3-pyridyl ketone?
You can request a quote for 4-Methyl-6-(3-pyridylcarbonylthio)pyrimidin-2-ylthio 3-pyridyl ketone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Methyl-6-(3-pyridylcarbonylthio)pyrimidin-2-ylthio 3-pyridyl ketone?
Yes, KEHONG BIO provides custom synthesis services for 4-Methyl-6-(3-pyridylcarbonylthio)pyrimidin-2-ylthio 3-pyridyl ketone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.