![6-(1-Adamantyl)-2-[(2-pyridinylmethyl)sulfanyl]nicotinonitrile structure](/static/products/316/316360-87-9.png)
6-(1-Adamantyl)-2-[(2-pyridinylmethyl)sulfanyl]nicotinonitrile
TL;DR: 6-(1-Adamantyl)-2-[(2-pyridinylmethyl)sulfanyl]nicotinonitrile (CAS 316360-87-9) is a chemical compound with molecular formula C22H23N3S and molecular weight 361.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(1-adamantyl)-2-(pyridin-2-ylmethylsulfanyl)pyridine-3-carbonitrile
Also Known As: ChemDiv3_006963, IDI1_024873, BRD-K59849276-001-01-0, 6-(1-adamantyl)-2-[(2-pyridinylmethyl)sulfanyl]nicotinonitrile, 6-(1-adamantyl)-2-(pyridin-2-ylmethylsulfanyl)pyridine-3-carbonitrile
| Molecular Formula | C22H23N3S |
|---|---|
| Molecular Weight | 361.16 g/mol |
| LogP | 5.10838 |
| Topological Polar Surface Area | 49.57 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 361.16125 |
| Heavy Atoms | 26 |
| Complexity | 820.15204 |
Chemical Identifiers
| CAS Number | 316360-87-9 |
|---|---|
| SMILES | C1C2CC3CC1CC(C2)(C3)C4=NC(=C(C=C4)C#N)SCC5=CC=CC=N5 |
Product Overview
6-(1-Adamantyl)-2-[(2-pyridinylmethyl)sulfanyl]nicotinonitrile (CAS 316360-87-9), with molecular formula C22H23N3S and molecular weight 361.16 g/mol. IUPAC: 6-(1-adamantyl)-2-(pyridin-2-ylmethylsulfanyl)pyridine-3-carbonitrile.
Chemical Property Profile of 6-(1-Adamantyl)-2-[(2-pyridinylmethyl)sulfanyl]nicotinonitrile
Property Insights of 6-(1-Adamantyl)-2-[(2-pyridinylmethyl)sulfanyl]nicotinonitrile
The XLogP value of 5.10838 indicates that 6-(1-Adamantyl)-2-[(2-pyridinylmethyl)sulfanyl]nicotinonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.57 Ų, 6-(1-Adamantyl)-2-[(2-pyridinylmethyl)sulfanyl]nicotinonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-(1-Adamantyl)-2-[(2-pyridinylmethyl)sulfanyl]nicotinonitrile has 0 hydrogen bond donor(s) and 4 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-pyridinylmethyl)sulfanyl]nicotinonitrile?
The CAS number of 6-(1-Adamantyl)-2-[(2-pyridinylmethyl)sulfanyl]nicotinonitrile is 316360-87-9.
What is the molecular formula of 6-(1-Adamantyl)-2-[(2-pyridinylmethyl)sulfanyl]nicotinonitrile?
The molecular formula of 6-(1-Adamantyl)-2-[(2-pyridinylmethyl)sulfanyl]nicotinonitrile is C22H23N3S.
What is the molecular weight of 6-(1-Adamantyl)-2-[(2-pyridinylmethyl)sulfanyl]nicotinonitrile?
The molecular weight of 6-(1-Adamantyl)-2-[(2-pyridinylmethyl)sulfanyl]nicotinonitrile is 361.16 g/mol.
Where can I buy 6-(1-Adamantyl)-2-[(2-pyridinylmethyl)sulfanyl]nicotinonitrile?
You can request a quote for 6-(1-Adamantyl)-2-[(2-pyridinylmethyl)sulfanyl]nicotinonitrile 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-pyridinylmethyl)sulfanyl]nicotinonitrile?
Yes, KEHONG BIO provides custom synthesis services for 6-(1-Adamantyl)-2-[(2-pyridinylmethyl)sulfanyl]nicotinonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.