![1-(Isobutylamino)-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile structure](/static/products/6111/611196-75-9.webp)
1-(Isobutylamino)-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile
TL;DR: 1-(Isobutylamino)-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile (CAS 611196-75-9) is a chemical compound with molecular formula C17H18N4 and molecular weight 278.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methyl-1-(2-methylpropylamino)pyrido[1,2-a]benzimidazole-4-carbonitrile
Also Known As: 1-(isobutylamino)-3-methylbenzo[4,5]imidazo[1,2-a]pyridine-4-carbonitrile, 1-(isobutylamino)-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile, 3-methyl-1-(2-methylpropylamino)pyrido[1,2-a]benzimidazole-4-carbonitrile, F1616-0002, 11-methyl-13-[(2-methylpropyl)amino]-1,8-diazatricyclo[7.4.0.0^{2,7}]trideca-2(7),3,5,8,10,12-hexaene-10-carbonitrile
| Molecular Formula | C17H18N4 |
|---|---|
| Molecular Weight | 278.15 g/mol |
| LogP | 3.7355 |
| Topological Polar Surface Area | 53.12 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 278.15314 |
| Heavy Atoms | 21 |
| Complexity | 852.46454 |
Chemical Identifiers
| CAS Number | 611196-75-9 |
|---|---|
| SMILES | CC1=C(C2=NC3=CC=CC=C3N2C(=C1)NCC(C)C)C#N |
Product Overview
1-(Isobutylamino)-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile (CAS 611196-75-9), with molecular formula C17H18N4 and molecular weight 278.15 g/mol. IUPAC: 3-methyl-1-(2-methylpropylamino)pyrido[1,2-a]benzimidazole-4-carbonitrile.
Chemical Property Profile of 1-(Isobutylamino)-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile
Property Insights of 1-(Isobutylamino)-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile
The XLogP value of 3.7355 indicates that 1-(Isobutylamino)-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.12 Ų, 1-(Isobutylamino)-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(Isobutylamino)-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile has 1 hydrogen bond donor(s) and 3 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-(Isobutylamino)-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile?
The CAS number of 1-(Isobutylamino)-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile is 611196-75-9.
What is the molecular formula of 1-(Isobutylamino)-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile?
The molecular formula of 1-(Isobutylamino)-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile is C17H18N4.
What is the molecular weight of 1-(Isobutylamino)-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile?
The molecular weight of 1-(Isobutylamino)-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile is 278.15 g/mol.
Where can I buy 1-(Isobutylamino)-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile?
You can request a quote for 1-(Isobutylamino)-3-methylpyrido[1,2-a]benzimidazole-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-(Isobutylamino)-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 1-(Isobutylamino)-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.