6-Tert-butyl-4-methyl-2-(2-oxopropylsulfanyl)pyridine-3-carbonitrile
TL;DR: 6-Tert-butyl-4-methyl-2-(2-oxopropylsulfanyl)pyridine-3-carbonitrile (CAS 328274-64-2) is a chemical compound with molecular formula C14H18N2OS and molecular weight 262.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-tert-butyl-4-methyl-2-(2-oxopropylsulfanyl)pyridine-3-carbonitrile
Also Known As: 6-tert-butyl-4-methyl-2-(2-oxopropylsulfanyl)pyridine-3-carbonitrile, 6-tert-butyl-4-methyl-2-[(2-oxopropyl)sulfanyl]nicotinonitrile, 6-tert-butyl-4-methyl-2-[(2-oxopropyl)sulfanyl]pyridine-3-carbonitrile, 6-(tert-butyl)-4-methyl-2-(2-oxopropylthio)pyridine-3-carbonitrile
| Molecular Formula | C14H18N2OS |
|---|---|
| Molecular Weight | 262.11 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 79.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 262.11398 |
| Heavy Atoms | 18 |
| Complexity | 353.0 |
Chemical Identifiers
| CAS Number | 328274-64-2 |
|---|---|
| SMILES | CC1=CC(=NC(=C1C#N)SCC(=O)C)C(C)(C)C |
| InChIKey | DIOJIZDCNUZGLD-UHFFFAOYSA-N |
Product Overview
6-Tert-butyl-4-methyl-2-(2-oxopropylsulfanyl)pyridine-3-carbonitrile (CAS 328274-64-2), with molecular formula C14H18N2OS and molecular weight 262.11 g/mol. IUPAC: 6-tert-butyl-4-methyl-2-(2-oxopropylsulfanyl)pyridine-3-carbonitrile.
Chemical Property Profile of 6-Tert-butyl-4-methyl-2-(2-oxopropylsulfanyl)pyridine-3-carbonitrile
Property Insights of 6-Tert-butyl-4-methyl-2-(2-oxopropylsulfanyl)pyridine-3-carbonitrile
The XLogP value of 3.2 indicates that 6-Tert-butyl-4-methyl-2-(2-oxopropylsulfanyl)pyridine-3-carbonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-Tert-butyl-4-methyl-2-(2-oxopropylsulfanyl)pyridine-3-carbonitrile. Following Lipinski's Rule of Five, 6-Tert-butyl-4-methyl-2-(2-oxopropylsulfanyl)pyridine-3-carbonitrile has 0 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 6-Tert-butyl-4-methyl-2-(2-oxopropylsulfanyl)pyridine-3-carbonitrile?
The CAS number of 6-Tert-butyl-4-methyl-2-(2-oxopropylsulfanyl)pyridine-3-carbonitrile is 328274-64-2.
What is the molecular formula of 6-Tert-butyl-4-methyl-2-(2-oxopropylsulfanyl)pyridine-3-carbonitrile?
The molecular formula of 6-Tert-butyl-4-methyl-2-(2-oxopropylsulfanyl)pyridine-3-carbonitrile is C14H18N2OS.
What is the molecular weight of 6-Tert-butyl-4-methyl-2-(2-oxopropylsulfanyl)pyridine-3-carbonitrile?
The molecular weight of 6-Tert-butyl-4-methyl-2-(2-oxopropylsulfanyl)pyridine-3-carbonitrile is 262.11 g/mol.
Where can I buy 6-Tert-butyl-4-methyl-2-(2-oxopropylsulfanyl)pyridine-3-carbonitrile?
You can request a quote for 6-Tert-butyl-4-methyl-2-(2-oxopropylsulfanyl)pyridine-3-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Tert-butyl-4-methyl-2-(2-oxopropylsulfanyl)pyridine-3-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 6-Tert-butyl-4-methyl-2-(2-oxopropylsulfanyl)pyridine-3-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.