2-(5-Amino-1,3,4-thiadiazol-2-yl)-3-(2,4-dichlorophenyl)acrylonitrile
TL;DR: 2-(5-Amino-1,3,4-thiadiazol-2-yl)-3-(2,4-dichlorophenyl)acrylonitrile (CAS 338775-21-6) is a chemical compound with molecular formula C11H6Cl2N4S and molecular weight 295.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(5-amino-1,3,4-thiadiazol-2-yl)-3-(2,4-dichlorophenyl)prop-2-enenitrile
Also Known As: 2-(5-amino-1,3,4-thiadiazol-2-yl)-3-(2,4-dichlorophenyl)acrylonitrile, 2-(5-amino-1,3,4-thiadiazol-2-yl)-3-(2,4-dichlorophenyl)prop-2-enenitrile
| Molecular Formula | C11H6Cl2N4S |
|---|---|
| Molecular Weight | 295.97 g/mol |
| LogP | 3.49128 |
| Topological Polar Surface Area | 75.59 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 295.96902 |
| Heavy Atoms | 18 |
| Complexity | 657.3031 |
Chemical Identifiers
| CAS Number | 338775-21-6 |
|---|---|
| SMILES | C1=CC(=C(C=C1Cl)Cl)C=C(C#N)C2=NN=C(S2)N |
Product Overview
2-(5-Amino-1,3,4-thiadiazol-2-yl)-3-(2,4-dichlorophenyl)acrylonitrile (CAS 338775-21-6), with molecular formula C11H6Cl2N4S and molecular weight 295.97 g/mol. IUPAC: 2-(5-amino-1,3,4-thiadiazol-2-yl)-3-(2,4-dichlorophenyl)prop-2-enenitrile.
Chemical Property Profile of 2-(5-Amino-1,3,4-thiadiazol-2-yl)-3-(2,4-dichlorophenyl)acrylonitrile
Property Insights of 2-(5-Amino-1,3,4-thiadiazol-2-yl)-3-(2,4-dichlorophenyl)acrylonitrile
The XLogP value of 3.49128 indicates that 2-(5-Amino-1,3,4-thiadiazol-2-yl)-3-(2,4-dichlorophenyl)acrylonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.59 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(5-Amino-1,3,4-thiadiazol-2-yl)-3-(2,4-dichlorophenyl)acrylonitrile. Following Lipinski's Rule of Five, 2-(5-Amino-1,3,4-thiadiazol-2-yl)-3-(2,4-dichlorophenyl)acrylonitrile has 1 hydrogen bond donor(s) and 5 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-(5-Amino-1,3,4-thiadiazol-2-yl)-3-(2,4-dichlorophenyl)acrylonitrile?
The CAS number of 2-(5-Amino-1,3,4-thiadiazol-2-yl)-3-(2,4-dichlorophenyl)acrylonitrile is 338775-21-6.
What is the molecular formula of 2-(5-Amino-1,3,4-thiadiazol-2-yl)-3-(2,4-dichlorophenyl)acrylonitrile?
The molecular formula of 2-(5-Amino-1,3,4-thiadiazol-2-yl)-3-(2,4-dichlorophenyl)acrylonitrile is C11H6Cl2N4S.
What is the molecular weight of 2-(5-Amino-1,3,4-thiadiazol-2-yl)-3-(2,4-dichlorophenyl)acrylonitrile?
The molecular weight of 2-(5-Amino-1,3,4-thiadiazol-2-yl)-3-(2,4-dichlorophenyl)acrylonitrile is 295.97 g/mol.
Where can I buy 2-(5-Amino-1,3,4-thiadiazol-2-yl)-3-(2,4-dichlorophenyl)acrylonitrile?
You can request a quote for 2-(5-Amino-1,3,4-thiadiazol-2-yl)-3-(2,4-dichlorophenyl)acrylonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(5-Amino-1,3,4-thiadiazol-2-yl)-3-(2,4-dichlorophenyl)acrylonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-(5-Amino-1,3,4-thiadiazol-2-yl)-3-(2,4-dichlorophenyl)acrylonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.