2-((5-(2-chlorophenyl)-2H-tetrazol-2-yl)methyl)benzonitrile
TL;DR: 2-((5-(2-chlorophenyl)-2H-tetrazol-2-yl)methyl)benzonitrile (CAS 903853-16-7) is a chemical compound with molecular formula C15H10ClN5 and molecular weight 295.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[5-(2-chlorophenyl)tetrazol-2-yl]methyl]benzonitrile
Also Known As: 2-((5-(2-chlorophenyl)-2H-tetrazol-2-yl)methyl)benzonitrile, 2-{[5-(2-chlorophenyl)-2H-tetrazol-2-yl]methyl}benzonitrile
| Molecular Formula | C15H10ClN5 |
|---|---|
| Molecular Weight | 295.06 g/mol |
| LogP | 2.91348 |
| Topological Polar Surface Area | 67.39 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 295.06247 |
| Heavy Atoms | 21 |
| Complexity | 818.68134 |
Chemical Identifiers
| CAS Number | 903853-16-7 |
|---|---|
| SMILES | C1=CC=C(C(=C1)CN2N=C(N=N2)C3=CC=CC=C3Cl)C#N |
Product Overview
2-((5-(2-chlorophenyl)-2H-tetrazol-2-yl)methyl)benzonitrile (CAS 903853-16-7), with molecular formula C15H10ClN5 and molecular weight 295.06 g/mol. IUPAC: 2-[[5-(2-chlorophenyl)tetrazol-2-yl]methyl]benzonitrile.
Chemical Property Profile of 2-((5-(2-chlorophenyl)-2H-tetrazol-2-yl)methyl)benzonitrile
Property Insights of 2-((5-(2-chlorophenyl)-2H-tetrazol-2-yl)methyl)benzonitrile
The XLogP value of 2.91348 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-((5-(2-chlorophenyl)-2H-tetrazol-2-yl)methyl)benzonitrile. The TPSA of 67.39 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-((5-(2-chlorophenyl)-2H-tetrazol-2-yl)methyl)benzonitrile. Following Lipinski's Rule of Five, 2-((5-(2-chlorophenyl)-2H-tetrazol-2-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-((5-(2-chlorophenyl)-2H-tetrazol-2-yl)methyl)benzonitrile?
The CAS number of 2-((5-(2-chlorophenyl)-2H-tetrazol-2-yl)methyl)benzonitrile is 903853-16-7.
What is the molecular formula of 2-((5-(2-chlorophenyl)-2H-tetrazol-2-yl)methyl)benzonitrile?
The molecular formula of 2-((5-(2-chlorophenyl)-2H-tetrazol-2-yl)methyl)benzonitrile is C15H10ClN5.
What is the molecular weight of 2-((5-(2-chlorophenyl)-2H-tetrazol-2-yl)methyl)benzonitrile?
The molecular weight of 2-((5-(2-chlorophenyl)-2H-tetrazol-2-yl)methyl)benzonitrile is 295.06 g/mol.
Where can I buy 2-((5-(2-chlorophenyl)-2H-tetrazol-2-yl)methyl)benzonitrile?
You can request a quote for 2-((5-(2-chlorophenyl)-2H-tetrazol-2-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-((5-(2-chlorophenyl)-2H-tetrazol-2-yl)methyl)benzonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-((5-(2-chlorophenyl)-2H-tetrazol-2-yl)methyl)benzonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.