![2-[(3-Pyridinylmethyl)sulfanyl]-4,6-di(2-thienyl)nicotinonitrile structure](/static/products/4968/496804-71-8.webp)
2-[(3-Pyridinylmethyl)sulfanyl]-4,6-di(2-thienyl)nicotinonitrile
TL;DR: 2-[(3-Pyridinylmethyl)sulfanyl]-4,6-di(2-thienyl)nicotinonitrile (CAS 496804-71-8) is a chemical compound with molecular formula C20H13N3S3 and molecular weight 391.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(pyridin-3-ylmethylsulfanyl)-4,6-dithiophen-2-ylpyridine-3-carbonitrile
Also Known As: BAS 06900033, 2-[(3-pyridinylmethyl)sulfanyl]-4,6-di(2-thienyl)nicotinonitrile, AM-807/14146649, 2-(pyridin-3-ylmethylsulfanyl)-4,6-dithiophen-2-ylpyridine-3-carbonitrile, 2-(3-pyridylmethylthio)-4,6-di(2-thienyl)pyridine-3-carbonitrile
| Molecular Formula | C20H13N3S3 |
|---|---|
| Molecular Weight | 391.03 g/mol |
| LogP | 6.09758 |
| Topological Polar Surface Area | 49.57 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 391.02716 |
| Heavy Atoms | 26 |
| Complexity | 1034.1123 |
Chemical Identifiers
| CAS Number | 496804-71-8 |
|---|---|
| SMILES | C1=CC(=CN=C1)CSC2=C(C(=CC(=N2)C3=CC=CS3)C4=CC=CS4)C#N |
Product Overview
2-[(3-Pyridinylmethyl)sulfanyl]-4,6-di(2-thienyl)nicotinonitrile (CAS 496804-71-8), with molecular formula C20H13N3S3 and molecular weight 391.03 g/mol. IUPAC: 2-(pyridin-3-ylmethylsulfanyl)-4,6-dithiophen-2-ylpyridine-3-carbonitrile.
Chemical Property Profile of 2-[(3-Pyridinylmethyl)sulfanyl]-4,6-di(2-thienyl)nicotinonitrile
Property Insights of 2-[(3-Pyridinylmethyl)sulfanyl]-4,6-di(2-thienyl)nicotinonitrile
The XLogP value of 6.09758 indicates that 2-[(3-Pyridinylmethyl)sulfanyl]-4,6-di(2-thienyl)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, 2-[(3-Pyridinylmethyl)sulfanyl]-4,6-di(2-thienyl)nicotinonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[(3-Pyridinylmethyl)sulfanyl]-4,6-di(2-thienyl)nicotinonitrile has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-[(3-Pyridinylmethyl)sulfanyl]-4,6-di(2-thienyl)nicotinonitrile?
The CAS number of 2-[(3-Pyridinylmethyl)sulfanyl]-4,6-di(2-thienyl)nicotinonitrile is 496804-71-8.
What is the molecular formula of 2-[(3-Pyridinylmethyl)sulfanyl]-4,6-di(2-thienyl)nicotinonitrile?
The molecular formula of 2-[(3-Pyridinylmethyl)sulfanyl]-4,6-di(2-thienyl)nicotinonitrile is C20H13N3S3.
What is the molecular weight of 2-[(3-Pyridinylmethyl)sulfanyl]-4,6-di(2-thienyl)nicotinonitrile?
The molecular weight of 2-[(3-Pyridinylmethyl)sulfanyl]-4,6-di(2-thienyl)nicotinonitrile is 391.03 g/mol.
Where can I buy 2-[(3-Pyridinylmethyl)sulfanyl]-4,6-di(2-thienyl)nicotinonitrile?
You can request a quote for 2-[(3-Pyridinylmethyl)sulfanyl]-4,6-di(2-thienyl)nicotinonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(3-Pyridinylmethyl)sulfanyl]-4,6-di(2-thienyl)nicotinonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-[(3-Pyridinylmethyl)sulfanyl]-4,6-di(2-thienyl)nicotinonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.