![2-{2-[(1Z)-3-amino-2-cyano-3-thioxoprop-1-en-1-yl]phenoxy}acetamide structure](/static/products/838/838255-70-2.png)
2-{2-[(1Z)-3-amino-2-cyano-3-thioxoprop-1-en-1-yl]phenoxy}acetamide
TL;DR: 2-{2-[(1Z)-3-amino-2-cyano-3-thioxoprop-1-en-1-yl]phenoxy}acetamide (CAS 838255-70-2) is a chemical compound with molecular formula C12H11N3O2S and molecular weight 261.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-[(Z)-3-amino-2-cyano-3-sulfanylideneprop-1-enyl]phenoxy]acetamide
Also Known As: (Z)-2-(2-(3-amino-2-cyano-3-thioxoprop-1-en-1-yl)phenoxy)acetamide, 2-[2-[(Z)-3-amino-2-cyano-3-sulfanylideneprop-1-enyl]phenoxy]acetamide, 2-{2-[(1Z)-3-amino-2-cyano-3-thioxoprop-1-en-1-yl]phenoxy}acetamide
| Molecular Formula | C12H11N3O2S |
|---|---|
| Molecular Weight | 261.06 g/mol |
| LogP | 0.74378 |
| Topological Polar Surface Area | 102.13 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 261.0572 |
| Heavy Atoms | 18 |
| Complexity | 546.49866 |
Chemical Identifiers
| CAS Number | 838255-70-2 |
|---|---|
| SMILES | C1=CC=C(C(=C1)/C=C(/C#N)\C(=S)N)OCC(=O)N |
Product Overview
2-{2-[(1Z)-3-amino-2-cyano-3-thioxoprop-1-en-1-yl]phenoxy}acetamide (CAS 838255-70-2), with molecular formula C12H11N3O2S and molecular weight 261.06 g/mol. IUPAC: 2-[2-[(Z)-3-amino-2-cyano-3-sulfanylideneprop-1-enyl]phenoxy]acetamide.
Chemical Property Profile of 2-{2-[(1Z)-3-amino-2-cyano-3-thioxoprop-1-en-1-yl]phenoxy}acetamide
Property Insights of 2-{2-[(1Z)-3-amino-2-cyano-3-thioxoprop-1-en-1-yl]phenoxy}acetamide
The XLogP value of 0.74378 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-{2-[(1Z)-3-amino-2-cyano-3-thioxoprop-1-en-1-yl]phenoxy}acetamide. The TPSA of 102.13 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-{2-[(1Z)-3-amino-2-cyano-3-thioxoprop-1-en-1-yl]phenoxy}acetamide. Following Lipinski's Rule of Five, 2-{2-[(1Z)-3-amino-2-cyano-3-thioxoprop-1-en-1-yl]phenoxy}acetamide 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-{2-[(1Z)-3-amino-2-cyano-3-thioxoprop-1-en-1-yl]phenoxy}acetamide?
The CAS number of 2-{2-[(1Z)-3-amino-2-cyano-3-thioxoprop-1-en-1-yl]phenoxy}acetamide is 838255-70-2.
What is the molecular formula of 2-{2-[(1Z)-3-amino-2-cyano-3-thioxoprop-1-en-1-yl]phenoxy}acetamide?
The molecular formula of 2-{2-[(1Z)-3-amino-2-cyano-3-thioxoprop-1-en-1-yl]phenoxy}acetamide is C12H11N3O2S.
What is the molecular weight of 2-{2-[(1Z)-3-amino-2-cyano-3-thioxoprop-1-en-1-yl]phenoxy}acetamide?
The molecular weight of 2-{2-[(1Z)-3-amino-2-cyano-3-thioxoprop-1-en-1-yl]phenoxy}acetamide is 261.06 g/mol.
Where can I buy 2-{2-[(1Z)-3-amino-2-cyano-3-thioxoprop-1-en-1-yl]phenoxy}acetamide?
You can request a quote for 2-{2-[(1Z)-3-amino-2-cyano-3-thioxoprop-1-en-1-yl]phenoxy}acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-{2-[(1Z)-3-amino-2-cyano-3-thioxoprop-1-en-1-yl]phenoxy}acetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-{2-[(1Z)-3-amino-2-cyano-3-thioxoprop-1-en-1-yl]phenoxy}acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.