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2-[[2-(1,3-Thiazol-4-yl)benzimidazol-1-yl]methyl]benzonitrile
TL;DR: 2-[[2-(1,3-Thiazol-4-yl)benzimidazol-1-yl]methyl]benzonitrile (CAS 333414-58-7) is a chemical compound with molecular formula C18H12N4S and molecular weight 316.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[2-(1,3-thiazol-4-yl)benzimidazol-1-yl]methyl]benzonitrile
Also Known As: 2-[[2-(1,3-thiazol-4-yl)benzimidazol-1-yl]methyl]benzonitrile, 2-{[2-(1,3-thiazol-4-yl)-1H-benzimidazol-1-yl]methyl}benzonitrile, 2-((2-(thiazol-4-yl)-1H-benzo[d]imidazol-1-yl)methyl)benzonitrile, 2-[(2-(1,3-thiazol-4-yl)benzimidazolyl)methyl]benzenecarbonitrile, 2-{[2-(1,3-THIAZOL-4-YL)-1,3-BENZODIAZOL-1-YL]METHYL}BENZONITRILE
| Molecular Formula | C18H12N4S |
|---|---|
| Molecular Weight | 316.08 g/mol |
| LogP | 4.07978 |
| Topological Polar Surface Area | 54.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 316.07828 |
| Heavy Atoms | 23 |
| Complexity | 1009.1174 |
Chemical Identifiers
| CAS Number | 333414-58-7 |
|---|---|
| SMILES | C1=CC=C(C(=C1)CN2C3=CC=CC=C3N=C2C4=CSC=N4)C#N |
Product Overview
2-[[2-(1,3-Thiazol-4-yl)benzimidazol-1-yl]methyl]benzonitrile (CAS 333414-58-7), with molecular formula C18H12N4S and molecular weight 316.08 g/mol. IUPAC: 2-[[2-(1,3-thiazol-4-yl)benzimidazol-1-yl]methyl]benzonitrile.
Chemical Property Profile of 2-[[2-(1,3-Thiazol-4-yl)benzimidazol-1-yl]methyl]benzonitrile
Property Insights of 2-[[2-(1,3-Thiazol-4-yl)benzimidazol-1-yl]methyl]benzonitrile
The XLogP value of 4.07978 indicates that 2-[[2-(1,3-Thiazol-4-yl)benzimidazol-1-yl]methyl]benzonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.5 Ų, 2-[[2-(1,3-Thiazol-4-yl)benzimidazol-1-yl]methyl]benzonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[[2-(1,3-Thiazol-4-yl)benzimidazol-1-yl]methyl]benzonitrile 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 2-[[2-(1,3-Thiazol-4-yl)benzimidazol-1-yl]methyl]benzonitrile?
The CAS number of 2-[[2-(1,3-Thiazol-4-yl)benzimidazol-1-yl]methyl]benzonitrile is 333414-58-7.
What is the molecular formula of 2-[[2-(1,3-Thiazol-4-yl)benzimidazol-1-yl]methyl]benzonitrile?
The molecular formula of 2-[[2-(1,3-Thiazol-4-yl)benzimidazol-1-yl]methyl]benzonitrile is C18H12N4S.
What is the molecular weight of 2-[[2-(1,3-Thiazol-4-yl)benzimidazol-1-yl]methyl]benzonitrile?
The molecular weight of 2-[[2-(1,3-Thiazol-4-yl)benzimidazol-1-yl]methyl]benzonitrile is 316.08 g/mol.
Where can I buy 2-[[2-(1,3-Thiazol-4-yl)benzimidazol-1-yl]methyl]benzonitrile?
You can request a quote for 2-[[2-(1,3-Thiazol-4-yl)benzimidazol-1-yl]methyl]benzonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[[2-(1,3-Thiazol-4-yl)benzimidazol-1-yl]methyl]benzonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-[[2-(1,3-Thiazol-4-yl)benzimidazol-1-yl]methyl]benzonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.