![1-Hydroxy-3-methyl-2-(4-methyl-benzyl)-benzo[4,5]imidazo[1,2-a]pyridine-4-carbonitrile structure](/static/products/849/849019-32-5.png)
1-Hydroxy-3-methyl-2-(4-methyl-benzyl)-benzo[4,5]imidazo[1,2-a]pyridine-4-carbonitrile
TL;DR: 1-Hydroxy-3-methyl-2-(4-methyl-benzyl)-benzo[4,5]imidazo[1,2-a]pyridine-4-carbonitrile (CAS 849019-32-5) is a chemical compound with molecular formula C21H17N3O and molecular weight 327.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methyl-2-[(4-methylphenyl)methyl]-1-oxo-5H-pyrido[1,2-a]benzimidazole-4-carbonitrile
Also Known As: 1-Hydroxy-3-methyl-2-(4-methyl-benzyl)-benzo[4,5]imidazo[1,2-a]pyridine-4-carbonitrile, 1-hydroxy-3-methyl-2-(4-methylbenzyl)benzo[4,5]imidazo[1,2-a]pyridine-4-carbonitrile, 1-HYDROXY-3-METHYL-2-(4-METHYLBENZYL)PYRIDO[1,2-A][1,3]BENZIMIDAZOL-4-YL CYANIDE, 3-methyl-2-[(4-methylphenyl)methyl]-1-oxo-5H-pyrido[1,2-a]benzimidazole-4-carbonitrile, 4-cyano-3-methyl-2-(4-methylbenzyl)pyrido[1,2-a][3,1]benzimidazol-5-ium-1-olate
| Molecular Formula | C21H17N3O |
|---|---|
| Molecular Weight | 327.14 g/mol |
| LogP | 3.86012 |
| Topological Polar Surface Area | 61.06 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 327.13718 |
| Heavy Atoms | 25 |
| Complexity | 1204.5715 |
Chemical Identifiers
| CAS Number | 849019-32-5 |
|---|---|
| SMILES | CC1=CC=C(C=C1)CC2=C(C(=C3NC4=CC=CC=C4N3C2=O)C#N)C |
Product Overview
1-Hydroxy-3-methyl-2-(4-methyl-benzyl)-benzo[4,5]imidazo[1,2-a]pyridine-4-carbonitrile (CAS 849019-32-5), with molecular formula C21H17N3O and molecular weight 327.14 g/mol. IUPAC: 3-methyl-2-[(4-methylphenyl)methyl]-1-oxo-5H-pyrido[1,2-a]benzimidazole-4-carbonitrile.
Chemical Property Profile of 1-Hydroxy-3-methyl-2-(4-methyl-benzyl)-benzo[4,5]imidazo[1,2-a]pyridine-4-carbonitrile
Property Insights of 1-Hydroxy-3-methyl-2-(4-methyl-benzyl)-benzo[4,5]imidazo[1,2-a]pyridine-4-carbonitrile
The XLogP value of 3.86012 indicates that 1-Hydroxy-3-methyl-2-(4-methyl-benzyl)-benzo[4,5]imidazo[1,2-a]pyridine-4-carbonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.06 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Hydroxy-3-methyl-2-(4-methyl-benzyl)-benzo[4,5]imidazo[1,2-a]pyridine-4-carbonitrile. Following Lipinski's Rule of Five, 1-Hydroxy-3-methyl-2-(4-methyl-benzyl)-benzo[4,5]imidazo[1,2-a]pyridine-4-carbonitrile has 1 hydrogen bond donor(s) and 2 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 1-Hydroxy-3-methyl-2-(4-methyl-benzyl)-benzo[4,5]imidazo[1,2-a]pyridine-4-carbonitrile?
The CAS number of 1-Hydroxy-3-methyl-2-(4-methyl-benzyl)-benzo[4,5]imidazo[1,2-a]pyridine-4-carbonitrile is 849019-32-5.
What is the molecular formula of 1-Hydroxy-3-methyl-2-(4-methyl-benzyl)-benzo[4,5]imidazo[1,2-a]pyridine-4-carbonitrile?
The molecular formula of 1-Hydroxy-3-methyl-2-(4-methyl-benzyl)-benzo[4,5]imidazo[1,2-a]pyridine-4-carbonitrile is C21H17N3O.
What is the molecular weight of 1-Hydroxy-3-methyl-2-(4-methyl-benzyl)-benzo[4,5]imidazo[1,2-a]pyridine-4-carbonitrile?
The molecular weight of 1-Hydroxy-3-methyl-2-(4-methyl-benzyl)-benzo[4,5]imidazo[1,2-a]pyridine-4-carbonitrile is 327.14 g/mol.
Where can I buy 1-Hydroxy-3-methyl-2-(4-methyl-benzyl)-benzo[4,5]imidazo[1,2-a]pyridine-4-carbonitrile?
You can request a quote for 1-Hydroxy-3-methyl-2-(4-methyl-benzyl)-benzo[4,5]imidazo[1,2-a]pyridine-4-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Hydroxy-3-methyl-2-(4-methyl-benzyl)-benzo[4,5]imidazo[1,2-a]pyridine-4-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 1-Hydroxy-3-methyl-2-(4-methyl-benzyl)-benzo[4,5]imidazo[1,2-a]pyridine-4-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.