![methyl 3-[4-cyano-3-methyl-1-(4-methylpiperazin-1-yl)pyrido[1,2-a]benzimidazol-2-yl]propanoate structure](/static/products/848/848739-35-5.png)
methyl 3-[4-cyano-3-methyl-1-(4-methylpiperazin-1-yl)pyrido[1,2-a]benzimidazol-2-yl]propanoate
TL;DR: methyl 3-[4-cyano-3-methyl-1-(4-methylpiperazin-1-yl)pyrido[1,2-a]benzimidazol-2-yl]propanoate (CAS 848739-35-5) is a chemical compound with molecular formula C22H25N5O2 and molecular weight 391.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-[4-cyano-3-methyl-1-(4-methylpiperazin-1-yl)pyrido[1,2-a]benzimidazol-2-yl]propanoate
Also Known As: methyl 3-[4-cyano-3-methyl-1-(4-methylpiperazin-1-yl)pyrido[1,2-a]benzimidazol-2-yl]propanoate, methyl 3-(4-cyano-3-methyl-1-(4-methylpiperazin-1-yl)benzo[4,5]imidazo[1,2-a]pyridin-2-yl)propanoate
| Molecular Formula | C22H25N5O2 |
|---|---|
| Molecular Weight | 391.20 g/mol |
| LogP | 2.525 |
| Topological Polar Surface Area | 73.87 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 391.20084 |
| Heavy Atoms | 29 |
| Complexity | 1119.8658 |
Chemical Identifiers
| CAS Number | 848739-35-5 |
|---|---|
| SMILES | CC1=C(C2=NC3=CC=CC=C3N2C(=C1CCC(=O)OC)N4CCN(CC4)C)C#N |
Product Overview
methyl 3-[4-cyano-3-methyl-1-(4-methylpiperazin-1-yl)pyrido[1,2-a]benzimidazol-2-yl]propanoate (CAS 848739-35-5), with molecular formula C22H25N5O2 and molecular weight 391.20 g/mol. IUPAC: methyl 3-[4-cyano-3-methyl-1-(4-methylpiperazin-1-yl)pyrido[1,2-a]benzimidazol-2-yl]propanoate.
Chemical Property Profile of methyl 3-[4-cyano-3-methyl-1-(4-methylpiperazin-1-yl)pyrido[1,2-a]benzimidazol-2-yl]propanoate
Property Insights of methyl 3-[4-cyano-3-methyl-1-(4-methylpiperazin-1-yl)pyrido[1,2-a]benzimidazol-2-yl]propanoate
The XLogP value of 2.525 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl 3-[4-cyano-3-methyl-1-(4-methylpiperazin-1-yl)pyrido[1,2-a]benzimidazol-2-yl]propanoate. The TPSA of 73.87 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl 3-[4-cyano-3-methyl-1-(4-methylpiperazin-1-yl)pyrido[1,2-a]benzimidazol-2-yl]propanoate. Following Lipinski's Rule of Five, methyl 3-[4-cyano-3-methyl-1-(4-methylpiperazin-1-yl)pyrido[1,2-a]benzimidazol-2-yl]propanoate has 0 hydrogen bond donor(s) and 6 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 methyl 3-[4-cyano-3-methyl-1-(4-methylpiperazin-1-yl)pyrido[1,2-a]benzimidazol-2-yl]propanoate?
The CAS number of methyl 3-[4-cyano-3-methyl-1-(4-methylpiperazin-1-yl)pyrido[1,2-a]benzimidazol-2-yl]propanoate is 848739-35-5.
What is the molecular formula of methyl 3-[4-cyano-3-methyl-1-(4-methylpiperazin-1-yl)pyrido[1,2-a]benzimidazol-2-yl]propanoate?
The molecular formula of methyl 3-[4-cyano-3-methyl-1-(4-methylpiperazin-1-yl)pyrido[1,2-a]benzimidazol-2-yl]propanoate is C22H25N5O2.
What is the molecular weight of methyl 3-[4-cyano-3-methyl-1-(4-methylpiperazin-1-yl)pyrido[1,2-a]benzimidazol-2-yl]propanoate?
The molecular weight of methyl 3-[4-cyano-3-methyl-1-(4-methylpiperazin-1-yl)pyrido[1,2-a]benzimidazol-2-yl]propanoate is 391.20 g/mol.
Where can I buy methyl 3-[4-cyano-3-methyl-1-(4-methylpiperazin-1-yl)pyrido[1,2-a]benzimidazol-2-yl]propanoate?
You can request a quote for methyl 3-[4-cyano-3-methyl-1-(4-methylpiperazin-1-yl)pyrido[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 methyl 3-[4-cyano-3-methyl-1-(4-methylpiperazin-1-yl)pyrido[1,2-a]benzimidazol-2-yl]propanoate?
Yes, KEHONG BIO provides custom synthesis services for methyl 3-[4-cyano-3-methyl-1-(4-methylpiperazin-1-yl)pyrido[1,2-a]benzimidazol-2-yl]propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.