![2-(1H-benzo[f]benzimidazol-2-ylsulfanylmethyl)benzonitrile structure](/static/products/830/830338-58-4.png)
2-(1H-benzo[f]benzimidazol-2-ylsulfanylmethyl)benzonitrile
TL;DR: 2-(1H-benzo[f]benzimidazol-2-ylsulfanylmethyl)benzonitrile (CAS 830338-58-4) is a chemical compound with molecular formula C19H13N3S and molecular weight 315.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1H-benzo[f]benzimidazol-2-ylsulfanylmethyl)benzonitrile
Also Known As: 2-(1H-benzo[f]benzimidazol-2-ylsulfanylmethyl)benzonitrile, 2-[(1H-naphtho[2,3-d]imidazol-2-ylsulfanyl)methyl]benzonitrile
| Molecular Formula | C19H13N3S |
|---|---|
| Molecular Weight | 315.08 g/mol |
| LogP | 4.88008 |
| Topological Polar Surface Area | 52.47 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 315.083 |
| Heavy Atoms | 23 |
| Complexity | 990.79065 |
Chemical Identifiers
| CAS Number | 830338-58-4 |
|---|---|
| SMILES | C1=CC=C2C=C3C(=CC2=C1)NC(=N3)SCC4=CC=CC=C4C#N |
Product Overview
2-(1H-benzo[f]benzimidazol-2-ylsulfanylmethyl)benzonitrile (CAS 830338-58-4), with molecular formula C19H13N3S and molecular weight 315.08 g/mol. IUPAC: 2-(1H-benzo[f]benzimidazol-2-ylsulfanylmethyl)benzonitrile.
Chemical Property Profile of 2-(1H-benzo[f]benzimidazol-2-ylsulfanylmethyl)benzonitrile
Property Insights of 2-(1H-benzo[f]benzimidazol-2-ylsulfanylmethyl)benzonitrile
The XLogP value of 4.88008 indicates that 2-(1H-benzo[f]benzimidazol-2-ylsulfanylmethyl)benzonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.47 Ų, 2-(1H-benzo[f]benzimidazol-2-ylsulfanylmethyl)benzonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(1H-benzo[f]benzimidazol-2-ylsulfanylmethyl)benzonitrile 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 2-(1H-benzo[f]benzimidazol-2-ylsulfanylmethyl)benzonitrile?
The CAS number of 2-(1H-benzo[f]benzimidazol-2-ylsulfanylmethyl)benzonitrile is 830338-58-4.
What is the molecular formula of 2-(1H-benzo[f]benzimidazol-2-ylsulfanylmethyl)benzonitrile?
The molecular formula of 2-(1H-benzo[f]benzimidazol-2-ylsulfanylmethyl)benzonitrile is C19H13N3S.
What is the molecular weight of 2-(1H-benzo[f]benzimidazol-2-ylsulfanylmethyl)benzonitrile?
The molecular weight of 2-(1H-benzo[f]benzimidazol-2-ylsulfanylmethyl)benzonitrile is 315.08 g/mol.
Where can I buy 2-(1H-benzo[f]benzimidazol-2-ylsulfanylmethyl)benzonitrile?
You can request a quote for 2-(1H-benzo[f]benzimidazol-2-ylsulfanylmethyl)benzonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(1H-benzo[f]benzimidazol-2-ylsulfanylmethyl)benzonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-(1H-benzo[f]benzimidazol-2-ylsulfanylmethyl)benzonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.