S-(3-cyano-4,6-diphenylpyridin-2-yl) O-ethyl carbonodithioate
TL;DR: S-(3-cyano-4,6-diphenylpyridin-2-yl) O-ethyl carbonodithioate (CAS 371958-86-0) is a chemical compound with molecular formula C21H16N2OS2 and molecular weight 376.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
O-ethyl (3-cyano-4,6-diphenyl-2-pyridinyl)sulfanylmethanethioate
Also Known As: S-(3-cyano-4,6-diphenylpyridin-2-yl) O-ethyl carbonodithioate, O-ethyl (3-cyano-4,6-diphenylpyridin-2-yl)sulfanylmethanethioate
| Molecular Formula | C21H16N2OS2 |
|---|---|
| Molecular Weight | 376.07 g/mol |
| LogP | 5.70078 |
| Topological Polar Surface Area | 45.91 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 376.0704 |
| Heavy Atoms | 26 |
| Complexity | 950.9951 |
Chemical Identifiers
| CAS Number | 371958-86-0 |
|---|---|
| SMILES | CCOC(=S)SC1=C(C(=CC(=N1)C2=CC=CC=C2)C3=CC=CC=C3)C#N |
Product Overview
S-(3-cyano-4,6-diphenylpyridin-2-yl) O-ethyl carbonodithioate (CAS 371958-86-0), with molecular formula C21H16N2OS2 and molecular weight 376.07 g/mol. IUPAC: O-ethyl (3-cyano-4,6-diphenyl-2-pyridinyl)sulfanylmethanethioate.
Chemical Property Profile of S-(3-cyano-4,6-diphenylpyridin-2-yl) O-ethyl carbonodithioate
Property Insights of S-(3-cyano-4,6-diphenylpyridin-2-yl) O-ethyl carbonodithioate
The XLogP value of 5.70078 indicates that S-(3-cyano-4,6-diphenylpyridin-2-yl) O-ethyl carbonodithioate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.91 Ų, S-(3-cyano-4,6-diphenylpyridin-2-yl) O-ethyl carbonodithioate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, S-(3-cyano-4,6-diphenylpyridin-2-yl) O-ethyl carbonodithioate has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of S-(3-cyano-4,6-diphenylpyridin-2-yl) O-ethyl carbonodithioate?
The CAS number of S-(3-cyano-4,6-diphenylpyridin-2-yl) O-ethyl carbonodithioate is 371958-86-0.
What is the molecular formula of S-(3-cyano-4,6-diphenylpyridin-2-yl) O-ethyl carbonodithioate?
The molecular formula of S-(3-cyano-4,6-diphenylpyridin-2-yl) O-ethyl carbonodithioate is C21H16N2OS2.
What is the molecular weight of S-(3-cyano-4,6-diphenylpyridin-2-yl) O-ethyl carbonodithioate?
The molecular weight of S-(3-cyano-4,6-diphenylpyridin-2-yl) O-ethyl carbonodithioate is 376.07 g/mol.
Where can I buy S-(3-cyano-4,6-diphenylpyridin-2-yl) O-ethyl carbonodithioate?
You can request a quote for S-(3-cyano-4,6-diphenylpyridin-2-yl) O-ethyl carbonodithioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for S-(3-cyano-4,6-diphenylpyridin-2-yl) O-ethyl carbonodithioate?
Yes, KEHONG BIO provides custom synthesis services for S-(3-cyano-4,6-diphenylpyridin-2-yl) O-ethyl carbonodithioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.