![5-[(2-Chlorobenzyl)amino]-2-(2-fluorophenyl)-1,3-oxazole-4-carbonitrile structure](/static/products/613/613651-93-7.png)
5-[(2-Chlorobenzyl)amino]-2-(2-fluorophenyl)-1,3-oxazole-4-carbonitrile
TL;DR: 5-[(2-Chlorobenzyl)amino]-2-(2-fluorophenyl)-1,3-oxazole-4-carbonitrile (CAS 613651-93-7) is a chemical compound with molecular formula C17H11ClFN3O and molecular weight 327.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(2-chlorophenyl)methylamino]-2-(2-fluorophenyl)-1,3-oxazole-4-carbonitrile
Also Known As: AB01310349-01, 5-[(2-chlorobenzyl)amino]-2-(2-fluorophenyl)-1,3-oxazole-4-carbonitrile, 5-((2-chlorobenzyl)amino)-2-(2-fluorophenyl)oxazole-4-carbonitrile, 5-[(2-chlorophenyl)methylamino]-2-(2-fluorophenyl)-1,3-oxazole-4-carbonitrile
| Molecular Formula | C17H11ClFN3O |
|---|---|
| Molecular Weight | 327.06 g/mol |
| LogP | 4.61788 |
| Topological Polar Surface Area | 61.85 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 327.05746 |
| Heavy Atoms | 23 |
| Complexity | 885.54016 |
Chemical Identifiers
| CAS Number | 613651-93-7 |
|---|---|
| SMILES | C1=CC=C(C(=C1)CNC2=C(N=C(O2)C3=CC=CC=C3F)C#N)Cl |
Product Overview
5-[(2-Chlorobenzyl)amino]-2-(2-fluorophenyl)-1,3-oxazole-4-carbonitrile (CAS 613651-93-7), with molecular formula C17H11ClFN3O and molecular weight 327.06 g/mol. IUPAC: 5-[(2-chlorophenyl)methylamino]-2-(2-fluorophenyl)-1,3-oxazole-4-carbonitrile.
Chemical Property Profile of 5-[(2-Chlorobenzyl)amino]-2-(2-fluorophenyl)-1,3-oxazole-4-carbonitrile
Property Insights of 5-[(2-Chlorobenzyl)amino]-2-(2-fluorophenyl)-1,3-oxazole-4-carbonitrile
The XLogP value of 4.61788 indicates that 5-[(2-Chlorobenzyl)amino]-2-(2-fluorophenyl)-1,3-oxazole-4-carbonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.85 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-[(2-Chlorobenzyl)amino]-2-(2-fluorophenyl)-1,3-oxazole-4-carbonitrile. Following Lipinski's Rule of Five, 5-[(2-Chlorobenzyl)amino]-2-(2-fluorophenyl)-1,3-oxazole-4-carbonitrile has 1 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 5-[(2-Chlorobenzyl)amino]-2-(2-fluorophenyl)-1,3-oxazole-4-carbonitrile?
The CAS number of 5-[(2-Chlorobenzyl)amino]-2-(2-fluorophenyl)-1,3-oxazole-4-carbonitrile is 613651-93-7.
What is the molecular formula of 5-[(2-Chlorobenzyl)amino]-2-(2-fluorophenyl)-1,3-oxazole-4-carbonitrile?
The molecular formula of 5-[(2-Chlorobenzyl)amino]-2-(2-fluorophenyl)-1,3-oxazole-4-carbonitrile is C17H11ClFN3O.
What is the molecular weight of 5-[(2-Chlorobenzyl)amino]-2-(2-fluorophenyl)-1,3-oxazole-4-carbonitrile?
The molecular weight of 5-[(2-Chlorobenzyl)amino]-2-(2-fluorophenyl)-1,3-oxazole-4-carbonitrile is 327.06 g/mol.
Where can I buy 5-[(2-Chlorobenzyl)amino]-2-(2-fluorophenyl)-1,3-oxazole-4-carbonitrile?
You can request a quote for 5-[(2-Chlorobenzyl)amino]-2-(2-fluorophenyl)-1,3-oxazole-4-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-[(2-Chlorobenzyl)amino]-2-(2-fluorophenyl)-1,3-oxazole-4-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 5-[(2-Chlorobenzyl)amino]-2-(2-fluorophenyl)-1,3-oxazole-4-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.