2-cyano-3-(3,5-dibromo-4-hydroxyphenyl)-N-(1,3-thiazol-2-yl)prop-2-enamide
TL;DR: 2-cyano-3-(3,5-dibromo-4-hydroxyphenyl)-N-(1,3-thiazol-2-yl)prop-2-enamide (CAS 734539-15-2) is a chemical compound with molecular formula C13H7Br2N3O2S and molecular weight 426.86 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-2-cyano-3-(3,5-dibromo-4-hydroxyphenyl)-N-(1,3-thiazol-2-yl)prop-2-enamide
Also Known As: AB00720161-01, (E)-2-cyano-3-(3,5-dibromo-4-hydroxyphenyl)-N-(1,3-thiazol-2-yl)prop-2-enamide, 2-cyano-3-(3,5-dibromo-4-hydroxy-phenyl)-N-(1,3-thiazol-2-yl)prop-2-enamide, 2-cyano-3-(3,5-dibromo-4-hydroxyphenyl)-N-(1,3-thiazol-2-yl)prop-2-enamide
| Molecular Formula | C13H7Br2N3O2S |
|---|---|
| Molecular Weight | 426.86 g/mol |
| LogP | 3.91938 |
| Topological Polar Surface Area | 86.01 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 426.86258 |
| Heavy Atoms | 21 |
| Complexity | 728.26715 |
Chemical Identifiers
| CAS Number | 734539-15-2 |
|---|---|
| SMILES | C1=CSC(=N1)NC(=O)/C(=C/C2=CC(=C(C(=C2)Br)O)Br)/C#N |
Product Overview
2-cyano-3-(3,5-dibromo-4-hydroxyphenyl)-N-(1,3-thiazol-2-yl)prop-2-enamide (CAS 734539-15-2), with molecular formula C13H7Br2N3O2S and molecular weight 426.86 g/mol. IUPAC: (E)-2-cyano-3-(3,5-dibromo-4-hydroxyphenyl)-N-(1,3-thiazol-2-yl)prop-2-enamide.
Chemical Property Profile of 2-cyano-3-(3,5-dibromo-4-hydroxyphenyl)-N-(1,3-thiazol-2-yl)prop-2-enamide
Property Insights of 2-cyano-3-(3,5-dibromo-4-hydroxyphenyl)-N-(1,3-thiazol-2-yl)prop-2-enamide
The XLogP value of 3.91938 indicates that 2-cyano-3-(3,5-dibromo-4-hydroxyphenyl)-N-(1,3-thiazol-2-yl)prop-2-enamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.01 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-cyano-3-(3,5-dibromo-4-hydroxyphenyl)-N-(1,3-thiazol-2-yl)prop-2-enamide. Following Lipinski's Rule of Five, 2-cyano-3-(3,5-dibromo-4-hydroxyphenyl)-N-(1,3-thiazol-2-yl)prop-2-enamide has 2 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-cyano-3-(3,5-dibromo-4-hydroxyphenyl)-N-(1,3-thiazol-2-yl)prop-2-enamide?
The CAS number of 2-cyano-3-(3,5-dibromo-4-hydroxyphenyl)-N-(1,3-thiazol-2-yl)prop-2-enamide is 734539-15-2.
What is the molecular formula of 2-cyano-3-(3,5-dibromo-4-hydroxyphenyl)-N-(1,3-thiazol-2-yl)prop-2-enamide?
The molecular formula of 2-cyano-3-(3,5-dibromo-4-hydroxyphenyl)-N-(1,3-thiazol-2-yl)prop-2-enamide is C13H7Br2N3O2S.
What is the molecular weight of 2-cyano-3-(3,5-dibromo-4-hydroxyphenyl)-N-(1,3-thiazol-2-yl)prop-2-enamide?
The molecular weight of 2-cyano-3-(3,5-dibromo-4-hydroxyphenyl)-N-(1,3-thiazol-2-yl)prop-2-enamide is 426.86 g/mol.
Where can I buy 2-cyano-3-(3,5-dibromo-4-hydroxyphenyl)-N-(1,3-thiazol-2-yl)prop-2-enamide?
You can request a quote for 2-cyano-3-(3,5-dibromo-4-hydroxyphenyl)-N-(1,3-thiazol-2-yl)prop-2-enamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-cyano-3-(3,5-dibromo-4-hydroxyphenyl)-N-(1,3-thiazol-2-yl)prop-2-enamide?
Yes, KEHONG BIO provides custom synthesis services for 2-cyano-3-(3,5-dibromo-4-hydroxyphenyl)-N-(1,3-thiazol-2-yl)prop-2-enamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.