![(2E)-2-cyano-3-(4-hexyloxy-3-methoxyphenyl)-N-(5-{[3-(trifluoromethyl)phenyl]m ethyl}(1,3-thiazol-2-yl))prop-2-enamide structure](/static/products/468/468771-98-4.png)
(2E)-2-cyano-3-(4-hexyloxy-3-methoxyphenyl)-N-(5-{[3-(trifluoromethyl)phenyl]m ethyl}(1,3-thiazol-2-yl))prop-2-enamide
TL;DR: (2E)-2-cyano-3-(4-hexyloxy-3-methoxyphenyl)-N-(5-{[3-(trifluoromethyl)phenyl]m ethyl}(1,3-thiazol-2-yl))prop-2-enamide (CAS 468771-98-4) is a chemical compound with molecular formula C28H28F3N3O3S and molecular weight 543.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-2-cyano-3-(4-hexoxy-3-methoxyphenyl)-N-[5-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazol-2-yl]prop-2-enamide
Also Known As: (2E)-2-cyano-3-(4-hexyloxy-3-methoxyphenyl)-N-(5-{[3-(trifluoromethyl)phenyl]m ethyl}(1,3-thiazol-2-yl))prop-2-enamide, (E)-2-cyano-3-(4-hexoxy-3-methoxyphenyl)-N-[5-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazol-2-yl]prop-2-enamide, 2-cyano-3-[4-(hexyloxy)-3-methoxyphenyl]-N-(5-{[3-(trifluoromethyl)phenyl]methyl}-1,3-thiazol-2-yl)prop-2-enamide
| Molecular Formula | C28H28F3N3O3S |
|---|---|
| Molecular Weight | 543.18 g/mol |
| LogP | 7.26608 |
| Topological Polar Surface Area | 84.24 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 12 |
| Exact Mass | 543.18036 |
| Heavy Atoms | 38 |
| Complexity | 1312.4032 |
Chemical Identifiers
| CAS Number | 468771-98-4 |
|---|---|
| SMILES | CCCCCCOC1=C(C=C(C=C1)/C=C(\C#N)/C(=O)NC2=NC=C(S2)CC3=CC(=CC=C3)C(F)(F)F)OC |
Product Overview
(2E)-2-cyano-3-(4-hexyloxy-3-methoxyphenyl)-N-(5-{[3-(trifluoromethyl)phenyl]m ethyl}(1,3-thiazol-2-yl))prop-2-enamide (CAS 468771-98-4), with molecular formula C28H28F3N3O3S and molecular weight 543.18 g/mol. IUPAC: (E)-2-cyano-3-(4-hexoxy-3-methoxyphenyl)-N-[5-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazol-2-yl]prop-2-enamide.
Chemical Property Profile of (2E)-2-cyano-3-(4-hexyloxy-3-methoxyphenyl)-N-(5-{[3-(trifluoromethyl)phenyl]m ethyl}(1,3-thiazol-2-yl))prop-2-enamide
Property Insights of (2E)-2-cyano-3-(4-hexyloxy-3-methoxyphenyl)-N-(5-{[3-(trifluoromethyl)phenyl]m ethyl}(1,3-thiazol-2-yl))prop-2-enamide
The XLogP value of 7.26608 indicates that (2E)-2-cyano-3-(4-hexyloxy-3-methoxyphenyl)-N-(5-{[3-(trifluoromethyl)phenyl]m ethyl}(1,3-thiazol-2-yl))prop-2-enamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.24 Ų falls within the moderate polarity range, balancing permeability and solubility for (2E)-2-cyano-3-(4-hexyloxy-3-methoxyphenyl)-N-(5-{[3-(trifluoromethyl)phenyl]m ethyl}(1,3-thiazol-2-yl))prop-2-enamide. Following Lipinski's Rule of Five, (2E)-2-cyano-3-(4-hexyloxy-3-methoxyphenyl)-N-(5-{[3-(trifluoromethyl)phenyl]m ethyl}(1,3-thiazol-2-yl))prop-2-enamide has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (2E)-2-cyano-3-(4-hexyloxy-3-methoxyphenyl)-N-(5-{[3-(trifluoromethyl)phenyl]m ethyl}(1,3-thiazol-2-yl))prop-2-enamide?
The CAS number of (2E)-2-cyano-3-(4-hexyloxy-3-methoxyphenyl)-N-(5-{[3-(trifluoromethyl)phenyl]m ethyl}(1,3-thiazol-2-yl))prop-2-enamide is 468771-98-4.
What is the molecular formula of (2E)-2-cyano-3-(4-hexyloxy-3-methoxyphenyl)-N-(5-{[3-(trifluoromethyl)phenyl]m ethyl}(1,3-thiazol-2-yl))prop-2-enamide?
The molecular formula of (2E)-2-cyano-3-(4-hexyloxy-3-methoxyphenyl)-N-(5-{[3-(trifluoromethyl)phenyl]m ethyl}(1,3-thiazol-2-yl))prop-2-enamide is C28H28F3N3O3S.
What is the molecular weight of (2E)-2-cyano-3-(4-hexyloxy-3-methoxyphenyl)-N-(5-{[3-(trifluoromethyl)phenyl]m ethyl}(1,3-thiazol-2-yl))prop-2-enamide?
The molecular weight of (2E)-2-cyano-3-(4-hexyloxy-3-methoxyphenyl)-N-(5-{[3-(trifluoromethyl)phenyl]m ethyl}(1,3-thiazol-2-yl))prop-2-enamide is 543.18 g/mol.
Where can I buy (2E)-2-cyano-3-(4-hexyloxy-3-methoxyphenyl)-N-(5-{[3-(trifluoromethyl)phenyl]m ethyl}(1,3-thiazol-2-yl))prop-2-enamide?
You can request a quote for (2E)-2-cyano-3-(4-hexyloxy-3-methoxyphenyl)-N-(5-{[3-(trifluoromethyl)phenyl]m ethyl}(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 (2E)-2-cyano-3-(4-hexyloxy-3-methoxyphenyl)-N-(5-{[3-(trifluoromethyl)phenyl]m ethyl}(1,3-thiazol-2-yl))prop-2-enamide?
Yes, KEHONG BIO provides custom synthesis services for (2E)-2-cyano-3-(4-hexyloxy-3-methoxyphenyl)-N-(5-{[3-(trifluoromethyl)phenyl]m ethyl}(1,3-thiazol-2-yl))prop-2-enamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.