(E)-2-cyano-3-[2-(2,4-dichlorophenoxy)phenyl]-2-propenethioamide
TL;DR: (E)-2-cyano-3-[2-(2,4-dichlorophenoxy)phenyl]-2-propenethioamide (CAS 866019-93-4) is a chemical compound with molecular formula C16H10Cl2N2OS and molecular weight 347.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-2-cyano-3-[2-(2,4-dichlorophenoxy)phenyl]prop-2-enethioamide
Also Known As: (E)-2-cyano-3-[2-(2,4-dichlorophenoxy)phenyl]-2-propenethioamide, (2E)-2-cyano-3-[2-(2,4-dichlorophenoxy)phenyl]prop-2-enethioamide, (E)-2-cyano-3-[2-(2,4-dichlorophenoxy)phenyl]prop-2-enethioamide, 4X-0322
| Molecular Formula | C16H10Cl2N2OS |
|---|---|
| Molecular Weight | 347.99 g/mol |
| LogP | 4.97878 |
| Topological Polar Surface Area | 59.04 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 347.98907 |
| Heavy Atoms | 22 |
| Complexity | 796.9731 |
Chemical Identifiers
| CAS Number | 866019-93-4 |
|---|---|
| SMILES | C1=CC=C(C(=C1)/C=C(\C#N)/C(=S)N)OC2=C(C=C(C=C2)Cl)Cl |
Product Overview
(E)-2-cyano-3-[2-(2,4-dichlorophenoxy)phenyl]-2-propenethioamide (CAS 866019-93-4), with molecular formula C16H10Cl2N2OS and molecular weight 347.99 g/mol. IUPAC: (E)-2-cyano-3-[2-(2,4-dichlorophenoxy)phenyl]prop-2-enethioamide.
Chemical Property Profile of (E)-2-cyano-3-[2-(2,4-dichlorophenoxy)phenyl]-2-propenethioamide
Property Insights of (E)-2-cyano-3-[2-(2,4-dichlorophenoxy)phenyl]-2-propenethioamide
The XLogP value of 4.97878 indicates that (E)-2-cyano-3-[2-(2,4-dichlorophenoxy)phenyl]-2-propenethioamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.04 Ų, (E)-2-cyano-3-[2-(2,4-dichlorophenoxy)phenyl]-2-propenethioamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (E)-2-cyano-3-[2-(2,4-dichlorophenoxy)phenyl]-2-propenethioamide has 1 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 (E)-2-cyano-3-[2-(2,4-dichlorophenoxy)phenyl]-2-propenethioamide?
The CAS number of (E)-2-cyano-3-[2-(2,4-dichlorophenoxy)phenyl]-2-propenethioamide is 866019-93-4.
What is the molecular formula of (E)-2-cyano-3-[2-(2,4-dichlorophenoxy)phenyl]-2-propenethioamide?
The molecular formula of (E)-2-cyano-3-[2-(2,4-dichlorophenoxy)phenyl]-2-propenethioamide is C16H10Cl2N2OS.
What is the molecular weight of (E)-2-cyano-3-[2-(2,4-dichlorophenoxy)phenyl]-2-propenethioamide?
The molecular weight of (E)-2-cyano-3-[2-(2,4-dichlorophenoxy)phenyl]-2-propenethioamide is 347.99 g/mol.
Where can I buy (E)-2-cyano-3-[2-(2,4-dichlorophenoxy)phenyl]-2-propenethioamide?
You can request a quote for (E)-2-cyano-3-[2-(2,4-dichlorophenoxy)phenyl]-2-propenethioamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-2-cyano-3-[2-(2,4-dichlorophenoxy)phenyl]-2-propenethioamide?
Yes, KEHONG BIO provides custom synthesis services for (E)-2-cyano-3-[2-(2,4-dichlorophenoxy)phenyl]-2-propenethioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.