![6-(1-Adamantyl)-2-[(2-chlorophenyl)methylsulfanyl]pyridine-3-carbonitrile structure](/static/products/3280/328068-29-7.webp)
6-(1-Adamantyl)-2-[(2-chlorophenyl)methylsulfanyl]pyridine-3-carbonitrile
TL;DR: 6-(1-Adamantyl)-2-[(2-chlorophenyl)methylsulfanyl]pyridine-3-carbonitrile (CAS 328068-29-7) is a chemical compound with molecular formula C23H23ClN2S and molecular weight 394.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(1-adamantyl)-2-[(2-chlorophenyl)methylsulfanyl]pyridine-3-carbonitrile
Also Known As: 6-(1-adamantyl)-2-[(2-chlorobenzyl)sulfanyl]nicotinonitrile, 6-(1-adamantyl)-2-[(2-chlorophenyl)methylsulfanyl]pyridine-3-carbonitrile, 6-((3r,5r,7r)-adamantan-1-yl)-2-((2-chlorobenzyl)thio)nicotinonitrile, 2-[(2-chlorobenzyl)sulfanyl]-6-(tricyclo[3.3.1.1~3,7~]dec-1-yl)pyridine-3-carbonitrile
| Molecular Formula | C23H23ClN2S |
|---|---|
| Molecular Weight | 394.13 g/mol |
| LogP | 6.36678 |
| Topological Polar Surface Area | 36.68 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 394.12704 |
| Heavy Atoms | 27 |
| Complexity | 881.5504 |
Chemical Identifiers
| CAS Number | 328068-29-7 |
|---|---|
| SMILES | C1C2CC3CC1CC(C2)(C3)C4=NC(=C(C=C4)C#N)SCC5=CC=CC=C5Cl |
Product Overview
6-(1-Adamantyl)-2-[(2-chlorophenyl)methylsulfanyl]pyridine-3-carbonitrile (CAS 328068-29-7), with molecular formula C23H23ClN2S and molecular weight 394.13 g/mol. IUPAC: 6-(1-adamantyl)-2-[(2-chlorophenyl)methylsulfanyl]pyridine-3-carbonitrile.
Chemical Property Profile of 6-(1-Adamantyl)-2-[(2-chlorophenyl)methylsulfanyl]pyridine-3-carbonitrile
Property Insights of 6-(1-Adamantyl)-2-[(2-chlorophenyl)methylsulfanyl]pyridine-3-carbonitrile
The XLogP value of 6.36678 indicates that 6-(1-Adamantyl)-2-[(2-chlorophenyl)methylsulfanyl]pyridine-3-carbonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 36.68 Ų, 6-(1-Adamantyl)-2-[(2-chlorophenyl)methylsulfanyl]pyridine-3-carbonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-(1-Adamantyl)-2-[(2-chlorophenyl)methylsulfanyl]pyridine-3-carbonitrile has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 6-(1-Adamantyl)-2-[(2-chlorophenyl)methylsulfanyl]pyridine-3-carbonitrile?
The CAS number of 6-(1-Adamantyl)-2-[(2-chlorophenyl)methylsulfanyl]pyridine-3-carbonitrile is 328068-29-7.
What is the molecular formula of 6-(1-Adamantyl)-2-[(2-chlorophenyl)methylsulfanyl]pyridine-3-carbonitrile?
The molecular formula of 6-(1-Adamantyl)-2-[(2-chlorophenyl)methylsulfanyl]pyridine-3-carbonitrile is C23H23ClN2S.
What is the molecular weight of 6-(1-Adamantyl)-2-[(2-chlorophenyl)methylsulfanyl]pyridine-3-carbonitrile?
The molecular weight of 6-(1-Adamantyl)-2-[(2-chlorophenyl)methylsulfanyl]pyridine-3-carbonitrile is 394.13 g/mol.
Where can I buy 6-(1-Adamantyl)-2-[(2-chlorophenyl)methylsulfanyl]pyridine-3-carbonitrile?
You can request a quote for 6-(1-Adamantyl)-2-[(2-chlorophenyl)methylsulfanyl]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-(1-Adamantyl)-2-[(2-chlorophenyl)methylsulfanyl]pyridine-3-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 6-(1-Adamantyl)-2-[(2-chlorophenyl)methylsulfanyl]pyridine-3-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.