A3434/0145729
TL;DR: A3434/0145729 (CAS 442572-53-4) is a chemical compound with molecular formula C20H16N6 and molecular weight 340.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-cyanoethyl)-3-methyl-1-(2-methylimidazol-1-yl)pyrido[1,2-a]benzimidazole-4-carbonitrile
Also Known As: A3434/0145729, 2-(2-cyanoethyl)-3-methyl-1-(2-methyl-1H-imidazol-1-yl)benzo[4,5]imidazo[1,2-a]pyridine-4-carbonitrile, 2-(2-CYANOETHYL)-3-METHYL-1-(2-METHYL-1H-IMIDAZOL-1-YL)PYRIDO[1,2-A][1,3]BENZIMIDAZOL-4-YL CYANIDE, 2-(2-cyanoethyl)-3-methyl-1-(2-methyl-1H-imidazol-1-yl)pyrido[1,2-a]benzimidazole-4-carbonitrile, 2-(2-cyanoethyl)-3-methyl-1-(2-methylimidazol-1-yl)pyrido[1,2-a]benzimidazole-4-carbonitrile
| Molecular Formula | C20H16N6 |
|---|---|
| Molecular Weight | 340.14 g/mol |
| LogP | 3.6179 |
| Topological Polar Surface Area | 82.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 340.14365 |
| Heavy Atoms | 26 |
| Complexity | 1229.3695 |
Chemical Identifiers
| CAS Number | 442572-53-4 |
|---|---|
| SMILES | CC1=C(C2=NC3=CC=CC=C3N2C(=C1CCC#N)N4C=CN=C4C)C#N |
Product Overview
A3434/0145729 (CAS 442572-53-4), with molecular formula C20H16N6 and molecular weight 340.14 g/mol. IUPAC: 2-(2-cyanoethyl)-3-methyl-1-(2-methylimidazol-1-yl)pyrido[1,2-a]benzimidazole-4-carbonitrile.
Chemical Property Profile of A3434/0145729
Property Insights of A3434/0145729
The XLogP value of 3.6179 indicates that A3434/0145729 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 82.7 Ų falls within the moderate polarity range, balancing permeability and solubility for A3434/0145729. Following Lipinski's Rule of Five, A3434/0145729 has 0 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 A3434/0145729?
The CAS number of A3434/0145729 is 442572-53-4.
What is the molecular formula of A3434/0145729?
The molecular formula of A3434/0145729 is C20H16N6.
What is the molecular weight of A3434/0145729?
The molecular weight of A3434/0145729 is 340.14 g/mol.
Where can I buy A3434/0145729?
You can request a quote for A3434/0145729 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3434/0145729?
Yes, KEHONG BIO provides custom synthesis services for A3434/0145729 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.