![ethyl 3-(1-anilino-4-cyano-3-methylpyrido[1,2-a]benzimidazol-2-yl)propanoate structure](/static/products/459/459791-87-8.png)
ethyl 3-(1-anilino-4-cyano-3-methylpyrido[1,2-a]benzimidazol-2-yl)propanoate
TL;DR: ethyl 3-(1-anilino-4-cyano-3-methylpyrido[1,2-a]benzimidazol-2-yl)propanoate (CAS 459791-87-8) is a chemical compound with molecular formula C24H22N4O2 and molecular weight 398.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-(1-anilino-4-cyano-3-methylpyrido[1,2-a]benzimidazol-2-yl)propanoate
Also Known As: ethyl 3-(1-anilino-4-cyano-3-methylpyrido[1,2-a]benzimidazol-2-yl)propanoate, ethyl 3-(4-cyano-3-methyl-1-(phenylamino)benzo[4,5]imidazo[1,2-a]pyridin-2-yl)propanoate, ethyl 3-[(1E)-4-cyano-3-methyl-1-(phenylimino)-1,5-dihydropyrido[1,2-a]benzimidazol-2-yl]propanoate
| Molecular Formula | C24H22N4O2 |
|---|---|
| Molecular Weight | 398.17 g/mol |
| LogP | 4.9069 |
| Topological Polar Surface Area | 79.42 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 398.1743 |
| Heavy Atoms | 30 |
| Complexity | 1269.589 |
Chemical Identifiers
| CAS Number | 459791-87-8 |
|---|---|
| SMILES | CCOC(=O)CCC1=C(N2C3=CC=CC=C3N=C2C(=C1C)C#N)NC4=CC=CC=C4 |
Product Overview
ethyl 3-(1-anilino-4-cyano-3-methylpyrido[1,2-a]benzimidazol-2-yl)propanoate (CAS 459791-87-8), with molecular formula C24H22N4O2 and molecular weight 398.17 g/mol. IUPAC: ethyl 3-(1-anilino-4-cyano-3-methylpyrido[1,2-a]benzimidazol-2-yl)propanoate.
Chemical Property Profile of ethyl 3-(1-anilino-4-cyano-3-methylpyrido[1,2-a]benzimidazol-2-yl)propanoate
Property Insights of ethyl 3-(1-anilino-4-cyano-3-methylpyrido[1,2-a]benzimidazol-2-yl)propanoate
The XLogP value of 4.9069 indicates that ethyl 3-(1-anilino-4-cyano-3-methylpyrido[1,2-a]benzimidazol-2-yl)propanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.42 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 3-(1-anilino-4-cyano-3-methylpyrido[1,2-a]benzimidazol-2-yl)propanoate. Following Lipinski's Rule of Five, ethyl 3-(1-anilino-4-cyano-3-methylpyrido[1,2-a]benzimidazol-2-yl)propanoate has 1 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 ethyl 3-(1-anilino-4-cyano-3-methylpyrido[1,2-a]benzimidazol-2-yl)propanoate?
The CAS number of ethyl 3-(1-anilino-4-cyano-3-methylpyrido[1,2-a]benzimidazol-2-yl)propanoate is 459791-87-8.
What is the molecular formula of ethyl 3-(1-anilino-4-cyano-3-methylpyrido[1,2-a]benzimidazol-2-yl)propanoate?
The molecular formula of ethyl 3-(1-anilino-4-cyano-3-methylpyrido[1,2-a]benzimidazol-2-yl)propanoate is C24H22N4O2.
What is the molecular weight of ethyl 3-(1-anilino-4-cyano-3-methylpyrido[1,2-a]benzimidazol-2-yl)propanoate?
The molecular weight of ethyl 3-(1-anilino-4-cyano-3-methylpyrido[1,2-a]benzimidazol-2-yl)propanoate is 398.17 g/mol.
Where can I buy ethyl 3-(1-anilino-4-cyano-3-methylpyrido[1,2-a]benzimidazol-2-yl)propanoate?
You can request a quote for ethyl 3-(1-anilino-4-cyano-3-methylpyrido[1,2-a]benzimidazol-2-yl)propanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl 3-(1-anilino-4-cyano-3-methylpyrido[1,2-a]benzimidazol-2-yl)propanoate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 3-(1-anilino-4-cyano-3-methylpyrido[1,2-a]benzimidazol-2-yl)propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.