2-(2,4-Dichlorophenyl)-2-(2-pyridinylsulfanyl)acetonitrile
TL;DR: 2-(2,4-Dichlorophenyl)-2-(2-pyridinylsulfanyl)acetonitrile (CAS 477865-16-0) is a chemical compound with molecular formula C13H8Cl2N2S and molecular weight 293.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2,4-dichlorophenyl)-2-pyridin-2-ylsulfanylacetonitrile
Also Known As: 2-(2,4-dichlorophenyl)-2-(2-pyridinylsulfanyl)acetonitrile, 2-(2,4-dichlorophenyl)-2-pyridin-2-ylsulfanylacetonitrile, 2-(2,4-dichlorophenyl)-2-(pyridin-2-ylsulfanyl)acetonitrile, 2,4-Dichloro-I+/--(2-pyridinylthio)benzeneacetonitrile, (2,4-Dichlorophenyl)[(pyridin-2-yl)sulfanyl]acetonitrile
| Molecular Formula | C13H8Cl2N2S |
|---|---|
| Molecular Weight | 293.98 g/mol |
| LogP | 4.74538 |
| Topological Polar Surface Area | 36.68 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 293.97852 |
| Heavy Atoms | 18 |
| Complexity | 581.2903 |
Chemical Identifiers
| CAS Number | 477865-16-0 |
|---|---|
| SMILES | C1=CC=NC(=C1)SC(C#N)C2=C(C=C(C=C2)Cl)Cl |
Product Overview
2-(2,4-Dichlorophenyl)-2-(2-pyridinylsulfanyl)acetonitrile (CAS 477865-16-0), with molecular formula C13H8Cl2N2S and molecular weight 293.98 g/mol. IUPAC: 2-(2,4-dichlorophenyl)-2-pyridin-2-ylsulfanylacetonitrile.
Chemical Property Profile of 2-(2,4-Dichlorophenyl)-2-(2-pyridinylsulfanyl)acetonitrile
Property Insights of 2-(2,4-Dichlorophenyl)-2-(2-pyridinylsulfanyl)acetonitrile
The XLogP value of 4.74538 indicates that 2-(2,4-Dichlorophenyl)-2-(2-pyridinylsulfanyl)acetonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 36.68 Ų, 2-(2,4-Dichlorophenyl)-2-(2-pyridinylsulfanyl)acetonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(2,4-Dichlorophenyl)-2-(2-pyridinylsulfanyl)acetonitrile has 0 hydrogen bond donor(s) and 3 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 2-(2,4-Dichlorophenyl)-2-(2-pyridinylsulfanyl)acetonitrile?
The CAS number of 2-(2,4-Dichlorophenyl)-2-(2-pyridinylsulfanyl)acetonitrile is 477865-16-0.
What is the molecular formula of 2-(2,4-Dichlorophenyl)-2-(2-pyridinylsulfanyl)acetonitrile?
The molecular formula of 2-(2,4-Dichlorophenyl)-2-(2-pyridinylsulfanyl)acetonitrile is C13H8Cl2N2S.
What is the molecular weight of 2-(2,4-Dichlorophenyl)-2-(2-pyridinylsulfanyl)acetonitrile?
The molecular weight of 2-(2,4-Dichlorophenyl)-2-(2-pyridinylsulfanyl)acetonitrile is 293.98 g/mol.
Where can I buy 2-(2,4-Dichlorophenyl)-2-(2-pyridinylsulfanyl)acetonitrile?
You can request a quote for 2-(2,4-Dichlorophenyl)-2-(2-pyridinylsulfanyl)acetonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2,4-Dichlorophenyl)-2-(2-pyridinylsulfanyl)acetonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-(2,4-Dichlorophenyl)-2-(2-pyridinylsulfanyl)acetonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.