![ethyl 2-[3-[(E)-2-cyano-3-(2,5-dimethylanilino)-3-oxoprop-1-enyl]indol-1-yl]acetate structure](/static/products/877/877783-08-9.png)
ethyl 2-[3-[(E)-2-cyano-3-(2,5-dimethylanilino)-3-oxoprop-1-enyl]indol-1-yl]acetate
TL;DR: ethyl 2-[3-[(E)-2-cyano-3-(2,5-dimethylanilino)-3-oxoprop-1-enyl]indol-1-yl]acetate (CAS 877783-08-9) is a chemical compound with molecular formula C24H23N3O3 and molecular weight 401.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[3-[(E)-2-cyano-3-(2,5-dimethylanilino)-3-oxoprop-1-enyl]indol-1-yl]acetate
Also Known As: ethyl 2-[3-[(E)-2-cyano-3-(2,5-dimethylanilino)-3-oxoprop-1-enyl]indol-1-yl]acetate, Ethyl 2-[3-[2-cyano-2-[(2,5-dimethylphenyl)carbamoyl]ethenyl]indol-1-yl]acetate, (E)-ethyl 2-(3-(2-cyano-3-((2,5-dimethylphenyl)amino)-3-oxoprop-1-en-1-yl)-1H-indol-1-yl)acetate, ethyl (3-{(1E)-2-cyano-3-[(2,5-dimethylphenyl)amino]-3-oxoprop-1-en-1-yl}-1H-indol-1-yl)acetate
| Molecular Formula | C24H23N3O3 |
|---|---|
| Molecular Weight | 401.17 g/mol |
| LogP | 4.36692 |
| Topological Polar Surface Area | 84.12 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 401.17395 |
| Heavy Atoms | 30 |
| Complexity | 1182.1146 |
Chemical Identifiers
| CAS Number | 877783-08-9 |
|---|---|
| SMILES | CCOC(=O)CN1C=C(C2=CC=CC=C21)/C=C(\C#N)/C(=O)NC3=C(C=CC(=C3)C)C |
Product Overview
ethyl 2-[3-[(E)-2-cyano-3-(2,5-dimethylanilino)-3-oxoprop-1-enyl]indol-1-yl]acetate (CAS 877783-08-9), with molecular formula C24H23N3O3 and molecular weight 401.17 g/mol. IUPAC: ethyl 2-[3-[(E)-2-cyano-3-(2,5-dimethylanilino)-3-oxoprop-1-enyl]indol-1-yl]acetate.
Chemical Property Profile of ethyl 2-[3-[(E)-2-cyano-3-(2,5-dimethylanilino)-3-oxoprop-1-enyl]indol-1-yl]acetate
Property Insights of ethyl 2-[3-[(E)-2-cyano-3-(2,5-dimethylanilino)-3-oxoprop-1-enyl]indol-1-yl]acetate
The XLogP value of 4.36692 indicates that ethyl 2-[3-[(E)-2-cyano-3-(2,5-dimethylanilino)-3-oxoprop-1-enyl]indol-1-yl]acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.12 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 2-[3-[(E)-2-cyano-3-(2,5-dimethylanilino)-3-oxoprop-1-enyl]indol-1-yl]acetate. Following Lipinski's Rule of Five, ethyl 2-[3-[(E)-2-cyano-3-(2,5-dimethylanilino)-3-oxoprop-1-enyl]indol-1-yl]acetate has 1 hydrogen bond donor(s) and 4 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 ethyl 2-[3-[(E)-2-cyano-3-(2,5-dimethylanilino)-3-oxoprop-1-enyl]indol-1-yl]acetate?
The CAS number of ethyl 2-[3-[(E)-2-cyano-3-(2,5-dimethylanilino)-3-oxoprop-1-enyl]indol-1-yl]acetate is 877783-08-9.
What is the molecular formula of ethyl 2-[3-[(E)-2-cyano-3-(2,5-dimethylanilino)-3-oxoprop-1-enyl]indol-1-yl]acetate?
The molecular formula of ethyl 2-[3-[(E)-2-cyano-3-(2,5-dimethylanilino)-3-oxoprop-1-enyl]indol-1-yl]acetate is C24H23N3O3.
What is the molecular weight of ethyl 2-[3-[(E)-2-cyano-3-(2,5-dimethylanilino)-3-oxoprop-1-enyl]indol-1-yl]acetate?
The molecular weight of ethyl 2-[3-[(E)-2-cyano-3-(2,5-dimethylanilino)-3-oxoprop-1-enyl]indol-1-yl]acetate is 401.17 g/mol.
Where can I buy ethyl 2-[3-[(E)-2-cyano-3-(2,5-dimethylanilino)-3-oxoprop-1-enyl]indol-1-yl]acetate?
You can request a quote for ethyl 2-[3-[(E)-2-cyano-3-(2,5-dimethylanilino)-3-oxoprop-1-enyl]indol-1-yl]acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl 2-[3-[(E)-2-cyano-3-(2,5-dimethylanilino)-3-oxoprop-1-enyl]indol-1-yl]acetate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 2-[3-[(E)-2-cyano-3-(2,5-dimethylanilino)-3-oxoprop-1-enyl]indol-1-yl]acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.