![2-Cyano-2-[(3,4-dimethylphenyl)hydrazono]ethanethioamide structure](/static/products/468/468102-45-6.png)
2-Cyano-2-[(3,4-dimethylphenyl)hydrazono]ethanethioamide
TL;DR: 2-Cyano-2-[(3,4-dimethylphenyl)hydrazono]ethanethioamide (CAS 468102-45-6) is a chemical compound with molecular formula C11H12N4S and molecular weight 232.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1E)-2-amino-N-(3,4-dimethylanilino)-2-sulfanylideneethanimidoyl cyanide
Also Known As: 2-cyano-2-[(3,4-dimethylphenyl)hydrazono]ethanethioamide, AN-329/40926269, (1E)-2-amino-N-(3,4-dimethylanilino)-2-sulfanylideneethanimidoyl cyanide, (2E)-2-cyano-2-[2-(3,4-dimethylphenyl)hydrazinylidene]ethanethioamide, (2E)-2-(aminothioxomethyl)-3-[(3,4-dimethylphenyl)amino]-3-azaprop-2-enenitril e
| Molecular Formula | C11H12N4S |
|---|---|
| Molecular Weight | 232.08 g/mol |
| LogP | 1.88102 |
| Topological Polar Surface Area | 74.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 232.07826 |
| Heavy Atoms | 16 |
| Complexity | 485.2482 |
Chemical Identifiers
| CAS Number | 468102-45-6 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)N/N=C(\C#N)/C(=S)N)C |
Product Overview
2-Cyano-2-[(3,4-dimethylphenyl)hydrazono]ethanethioamide (CAS 468102-45-6), with molecular formula C11H12N4S and molecular weight 232.08 g/mol. IUPAC: (1E)-2-amino-N-(3,4-dimethylanilino)-2-sulfanylideneethanimidoyl cyanide.
Chemical Property Profile of 2-Cyano-2-[(3,4-dimethylphenyl)hydrazono]ethanethioamide
Property Insights of 2-Cyano-2-[(3,4-dimethylphenyl)hydrazono]ethanethioamide
The XLogP value of 1.88102 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Cyano-2-[(3,4-dimethylphenyl)hydrazono]ethanethioamide. The TPSA of 74.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Cyano-2-[(3,4-dimethylphenyl)hydrazono]ethanethioamide. Following Lipinski's Rule of Five, 2-Cyano-2-[(3,4-dimethylphenyl)hydrazono]ethanethioamide has 2 hydrogen bond donor(s) and 4 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-Cyano-2-[(3,4-dimethylphenyl)hydrazono]ethanethioamide?
The CAS number of 2-Cyano-2-[(3,4-dimethylphenyl)hydrazono]ethanethioamide is 468102-45-6.
What is the molecular formula of 2-Cyano-2-[(3,4-dimethylphenyl)hydrazono]ethanethioamide?
The molecular formula of 2-Cyano-2-[(3,4-dimethylphenyl)hydrazono]ethanethioamide is C11H12N4S.
What is the molecular weight of 2-Cyano-2-[(3,4-dimethylphenyl)hydrazono]ethanethioamide?
The molecular weight of 2-Cyano-2-[(3,4-dimethylphenyl)hydrazono]ethanethioamide is 232.08 g/mol.
Where can I buy 2-Cyano-2-[(3,4-dimethylphenyl)hydrazono]ethanethioamide?
You can request a quote for 2-Cyano-2-[(3,4-dimethylphenyl)hydrazono]ethanethioamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Cyano-2-[(3,4-dimethylphenyl)hydrazono]ethanethioamide?
Yes, KEHONG BIO provides custom synthesis services for 2-Cyano-2-[(3,4-dimethylphenyl)hydrazono]ethanethioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.