![1-(Benzylsulfanyl)-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile structure](/static/products/862/862117-09-7.png)
1-(Benzylsulfanyl)-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile
TL;DR: 1-(Benzylsulfanyl)-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile (CAS 862117-09-7) is a chemical compound with molecular formula C20H15N3S and molecular weight 329.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-benzylsulfanyl-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile
Also Known As: UPCMLD0ENAT5747484:001, 1-benzylsulfanyl-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile, 1-(benzylsulfanyl)-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile, 1-(benzylthio)-3-methylbenzo[4,5]imidazo[1,2-a]pyridine-4-carbonitrile, 2-methyl-4-(phenylmethylthio)-5-hydropyridino[1,2-a]benzimidazolecarbonitrile
| Molecular Formula | C20H15N3S |
|---|---|
| Molecular Weight | 329.10 g/mol |
| LogP | 4.9599 |
| Topological Polar Surface Area | 41.09 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 329.09866 |
| Heavy Atoms | 24 |
| Complexity | 1074.8809 |
Chemical Identifiers
| CAS Number | 862117-09-7 |
|---|---|
| SMILES | CC1=C(C2=NC3=CC=CC=C3N2C(=C1)SCC4=CC=CC=C4)C#N |
Product Overview
1-(Benzylsulfanyl)-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile (CAS 862117-09-7), with molecular formula C20H15N3S and molecular weight 329.10 g/mol. IUPAC: 1-benzylsulfanyl-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile.
Chemical Property Profile of 1-(Benzylsulfanyl)-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile
Property Insights of 1-(Benzylsulfanyl)-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile
The XLogP value of 4.9599 indicates that 1-(Benzylsulfanyl)-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 41.09 Ų, 1-(Benzylsulfanyl)-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-(Benzylsulfanyl)-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile has 0 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-(Benzylsulfanyl)-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile?
The CAS number of 1-(Benzylsulfanyl)-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile is 862117-09-7.
What is the molecular formula of 1-(Benzylsulfanyl)-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile?
The molecular formula of 1-(Benzylsulfanyl)-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile is C20H15N3S.
What is the molecular weight of 1-(Benzylsulfanyl)-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile?
The molecular weight of 1-(Benzylsulfanyl)-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile is 329.10 g/mol.
Where can I buy 1-(Benzylsulfanyl)-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile?
You can request a quote for 1-(Benzylsulfanyl)-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-(Benzylsulfanyl)-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 1-(Benzylsulfanyl)-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.