2-Cyano-3-(4-hydroxyphenyl)thioacrylamide
TL;DR: 2-Cyano-3-(4-hydroxyphenyl)thioacrylamide (CAS 133149-51-6) is a chemical compound with molecular formula C10H8N2OS and molecular weight 204.03574 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-cyano-3-(4-hydroxyphenyl)prop-2-enethioamide
Also Known As: 2-cyano-3-(4-hydroxyphenyl)thioacrylamide, 2-Propenethioamide, 2-cyano-3-(4-hydroxyphenyl)-
Technical Specifications
| Molecular Formula | C10H8N2OS |
| Molecular Weight | 204.03574 g/mol |
| XLogP | 1.4 |
| Topological Polar Surface Area (TPSA) | 102.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 204.03574 Da |
| Heavy Atoms | 14 |
| Complexity | 294.0 |
| SMILES | C1=CC(=CC=C1C=C(C#N)C(=S)N)O |
| InChIKey | IUXXGYNXYSCATI-UHFFFAOYSA-N |
Chemical Property Profile of 2-Cyano-3-(4-hydroxyphenyl)thioacrylamide
Property Insights of 2-Cyano-3-(4-hydroxyphenyl)thioacrylamide
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Cyano-3-(4-hydroxyphenyl)thioacrylamide. The TPSA of 102.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Cyano-3-(4-hydroxyphenyl)thioacrylamide. Following Lipinski's Rule of Five, 2-Cyano-3-(4-hydroxyphenyl)thioacrylamide has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-Cyano-3-(4-hydroxyphenyl)thioacrylamide?
The CAS number of 2-Cyano-3-(4-hydroxyphenyl)thioacrylamide is 133149-51-6.
What is the molecular formula of 2-Cyano-3-(4-hydroxyphenyl)thioacrylamide?
The molecular formula of 2-Cyano-3-(4-hydroxyphenyl)thioacrylamide is C10H8N2OS.
What is the molecular weight of 2-Cyano-3-(4-hydroxyphenyl)thioacrylamide?
The molecular weight of 2-Cyano-3-(4-hydroxyphenyl)thioacrylamide is 204.03574 g/mol.
Where can I buy 2-Cyano-3-(4-hydroxyphenyl)thioacrylamide?
You can request a quote for 2-Cyano-3-(4-hydroxyphenyl)thioacrylamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Cyano-3-(4-hydroxyphenyl)thioacrylamide?
Yes, CoreyChem provides custom synthesis services for 2-Cyano-3-(4-hydroxyphenyl)thioacrylamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.