2-cyano-N-(4-fluorophenyl)-3-[1-[2-(4-tert-butylphenoxy)ethyl]indol-3-yl]prop-2-enamide
TL;DR: 2-cyano-N-(4-fluorophenyl)-3-[1-[2-(4-tert-butylphenoxy)ethyl]indol-3-yl]prop-2-enamide (CAS 340286-95-5) is a chemical compound with molecular formula C30H28FN3O2 and molecular weight 481.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-3-[1-[2-(4-tert-butylphenoxy)ethyl]indol-3-yl]-2-cyano-N-(4-fluorophenyl)prop-2-enamide
Also Known As: 2-cyano-N-(4-fluorophenyl)-3-[1-[2-(4-tert-butylphenoxy)ethyl]indol-3-yl]prop-2-enamide, (2E)-3-{1-[2-(4-tert-butylphenoxy)ethyl]-1H-indol-3-yl}-2-cyano-N-(4-fluorophenyl)prop-2-enamide, (E)-3-(1-(2-(4-(tert-butyl)phenoxy)ethyl)-1H-indol-3-yl)-2-cyano-N-(4-fluorophenyl)acrylamide, (E)-3-(1-{2-[4-(TERT-BUTYL)PHENOXY]ETHYL}-1H-INDOL-3-YL)-2-CYANO-N~1~-(4-FLUOROPHENYL)-2-PROPENAMIDE, (E)-3-[1-[2-(4-tert-butylphenoxy)ethyl]indol-3-yl]-2-cyano-N-(4-fluorophenyl)prop-2-enamide
| Molecular Formula | C30H28FN3O2 |
|---|---|
| Molecular Weight | 481.22 g/mol |
| LogP | 6.70258 |
| Topological Polar Surface Area | 67.05 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 481.21655 |
| Heavy Atoms | 36 |
| Complexity | 1437.0734 |
Chemical Identifiers
| CAS Number | 340286-95-5 |
|---|---|
| SMILES | CC(C)(C)C1=CC=C(C=C1)OCCN2C=C(C3=CC=CC=C32)/C=C(\C#N)/C(=O)NC4=CC=C(C=C4)F |
Product Overview
2-cyano-N-(4-fluorophenyl)-3-[1-[2-(4-tert-butylphenoxy)ethyl]indol-3-yl]prop-2-enamide (CAS 340286-95-5), with molecular formula C30H28FN3O2 and molecular weight 481.22 g/mol. IUPAC: (E)-3-[1-[2-(4-tert-butylphenoxy)ethyl]indol-3-yl]-2-cyano-N-(4-fluorophenyl)prop-2-enamide.
Chemical Property Profile of 2-cyano-N-(4-fluorophenyl)-3-[1-[2-(4-tert-butylphenoxy)ethyl]indol-3-yl]prop-2-enamide
Property Insights of 2-cyano-N-(4-fluorophenyl)-3-[1-[2-(4-tert-butylphenoxy)ethyl]indol-3-yl]prop-2-enamide
The XLogP value of 6.70258 indicates that 2-cyano-N-(4-fluorophenyl)-3-[1-[2-(4-tert-butylphenoxy)ethyl]indol-3-yl]prop-2-enamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.05 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-cyano-N-(4-fluorophenyl)-3-[1-[2-(4-tert-butylphenoxy)ethyl]indol-3-yl]prop-2-enamide. Following Lipinski's Rule of Five, 2-cyano-N-(4-fluorophenyl)-3-[1-[2-(4-tert-butylphenoxy)ethyl]indol-3-yl]prop-2-enamide has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-cyano-N-(4-fluorophenyl)-3-[1-[2-(4-tert-butylphenoxy)ethyl]indol-3-yl]prop-2-enamide?
The CAS number of 2-cyano-N-(4-fluorophenyl)-3-[1-[2-(4-tert-butylphenoxy)ethyl]indol-3-yl]prop-2-enamide is 340286-95-5.
What is the molecular formula of 2-cyano-N-(4-fluorophenyl)-3-[1-[2-(4-tert-butylphenoxy)ethyl]indol-3-yl]prop-2-enamide?
The molecular formula of 2-cyano-N-(4-fluorophenyl)-3-[1-[2-(4-tert-butylphenoxy)ethyl]indol-3-yl]prop-2-enamide is C30H28FN3O2.
What is the molecular weight of 2-cyano-N-(4-fluorophenyl)-3-[1-[2-(4-tert-butylphenoxy)ethyl]indol-3-yl]prop-2-enamide?
The molecular weight of 2-cyano-N-(4-fluorophenyl)-3-[1-[2-(4-tert-butylphenoxy)ethyl]indol-3-yl]prop-2-enamide is 481.22 g/mol.
Where can I buy 2-cyano-N-(4-fluorophenyl)-3-[1-[2-(4-tert-butylphenoxy)ethyl]indol-3-yl]prop-2-enamide?
You can request a quote for 2-cyano-N-(4-fluorophenyl)-3-[1-[2-(4-tert-butylphenoxy)ethyl]indol-3-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-N-(4-fluorophenyl)-3-[1-[2-(4-tert-butylphenoxy)ethyl]indol-3-yl]prop-2-enamide?
Yes, KEHONG BIO provides custom synthesis services for 2-cyano-N-(4-fluorophenyl)-3-[1-[2-(4-tert-butylphenoxy)ethyl]indol-3-yl]prop-2-enamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.