2-Cyano-3-(3,5-dibromo-4-hydroxyphenyl)prop-2-enamide
TL;DR: 2-Cyano-3-(3,5-dibromo-4-hydroxyphenyl)prop-2-enamide (CAS 104700-67-6) is a chemical compound with molecular formula C10H6Br2N2O2 and molecular weight 343.8796 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(Z)-2-cyano-3-(3,5-dibromo-4-hydroxyphenyl)prop-2-enamide
Also Known As: 2-cyano-3-(3,5-dibromo-4-hydroxyphenyl)prop-2-enamide, (Z)-2-cyano-3-(3,5-dibromo-4-hydroxyphenyl)prop-2-enamide
Technical Specifications
| Molecular Formula | C10H6Br2N2O2 |
| Molecular Weight | 343.8796 g/mol |
| XLogP | 2.2 |
| Topological Polar Surface Area (TPSA) | 87.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 343.8796 Da |
| Heavy Atoms | 16 |
| Complexity | 349.0 |
| SMILES | C1=C(C=C(C(=C1Br)O)Br)/C=C(/C#N)\C(=O)N |
| InChIKey | KBUWWCNCBZGKLE-BHQIHCQQSA-N |
Chemical Property Profile of 2-Cyano-3-(3,5-dibromo-4-hydroxyphenyl)prop-2-enamide
Property Insights of 2-Cyano-3-(3,5-dibromo-4-hydroxyphenyl)prop-2-enamide
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Cyano-3-(3,5-dibromo-4-hydroxyphenyl)prop-2-enamide. The TPSA of 87.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Cyano-3-(3,5-dibromo-4-hydroxyphenyl)prop-2-enamide. Following Lipinski's Rule of Five, 2-Cyano-3-(3,5-dibromo-4-hydroxyphenyl)prop-2-enamide 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-(3,5-dibromo-4-hydroxyphenyl)prop-2-enamide?
The CAS number of 2-Cyano-3-(3,5-dibromo-4-hydroxyphenyl)prop-2-enamide is 104700-67-6.
What is the molecular formula of 2-Cyano-3-(3,5-dibromo-4-hydroxyphenyl)prop-2-enamide?
The molecular formula of 2-Cyano-3-(3,5-dibromo-4-hydroxyphenyl)prop-2-enamide is C10H6Br2N2O2.
What is the molecular weight of 2-Cyano-3-(3,5-dibromo-4-hydroxyphenyl)prop-2-enamide?
The molecular weight of 2-Cyano-3-(3,5-dibromo-4-hydroxyphenyl)prop-2-enamide is 343.8796 g/mol.
Where can I buy 2-Cyano-3-(3,5-dibromo-4-hydroxyphenyl)prop-2-enamide?
You can request a quote for 2-Cyano-3-(3,5-dibromo-4-hydroxyphenyl)prop-2-enamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Cyano-3-(3,5-dibromo-4-hydroxyphenyl)prop-2-enamide?
Yes, CoreyChem provides custom synthesis services for 2-Cyano-3-(3,5-dibromo-4-hydroxyphenyl)prop-2-enamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.