![5-[(2-Chlorobenzyl)amino]-2-[(4-fluorophenoxy)methyl]-1,3-oxazole-4-carbonitrile structure](/static/products/606/606949-35-3.png)
5-[(2-Chlorobenzyl)amino]-2-[(4-fluorophenoxy)methyl]-1,3-oxazole-4-carbonitrile
TL;DR: 5-[(2-Chlorobenzyl)amino]-2-[(4-fluorophenoxy)methyl]-1,3-oxazole-4-carbonitrile (CAS 606949-35-3) is a chemical compound with molecular formula C18H13ClFN3O2 and molecular weight 357.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(2-chlorophenyl)methylamino]-2-[(4-fluorophenoxy)methyl]-1,3-oxazole-4-carbonitrile
Also Known As: 5-[(2-chlorobenzyl)amino]-2-[(4-fluorophenoxy)methyl]-1,3-oxazole-4-carbonitrile, 5-((2-chlorobenzyl)amino)-2-((4-fluorophenoxy)methyl)oxazole-4-carbonitrile, 5-[(2-chlorophenyl)methylamino]-2-[(4-fluorophenoxy)methyl]-1,3-oxazole-4-carbonitrile
| Molecular Formula | C18H13ClFN3O2 |
|---|---|
| Molecular Weight | 357.07 g/mol |
| LogP | 4.52988 |
| Topological Polar Surface Area | 71.08 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 357.06802 |
| Heavy Atoms | 25 |
| Complexity | 903.4298 |
Chemical Identifiers
| CAS Number | 606949-35-3 |
|---|---|
| SMILES | C1=CC=C(C(=C1)CNC2=C(N=C(O2)COC3=CC=C(C=C3)F)C#N)Cl |
Product Overview
5-[(2-Chlorobenzyl)amino]-2-[(4-fluorophenoxy)methyl]-1,3-oxazole-4-carbonitrile (CAS 606949-35-3), with molecular formula C18H13ClFN3O2 and molecular weight 357.07 g/mol. IUPAC: 5-[(2-chlorophenyl)methylamino]-2-[(4-fluorophenoxy)methyl]-1,3-oxazole-4-carbonitrile.
Chemical Property Profile of 5-[(2-Chlorobenzyl)amino]-2-[(4-fluorophenoxy)methyl]-1,3-oxazole-4-carbonitrile
Property Insights of 5-[(2-Chlorobenzyl)amino]-2-[(4-fluorophenoxy)methyl]-1,3-oxazole-4-carbonitrile
The XLogP value of 4.52988 indicates that 5-[(2-Chlorobenzyl)amino]-2-[(4-fluorophenoxy)methyl]-1,3-oxazole-4-carbonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.08 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-[(2-Chlorobenzyl)amino]-2-[(4-fluorophenoxy)methyl]-1,3-oxazole-4-carbonitrile. Following Lipinski's Rule of Five, 5-[(2-Chlorobenzyl)amino]-2-[(4-fluorophenoxy)methyl]-1,3-oxazole-4-carbonitrile has 1 hydrogen bond donor(s) and 5 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-[(4-fluorophenoxy)methyl]-1,3-oxazole-4-carbonitrile?
The CAS number of 5-[(2-Chlorobenzyl)amino]-2-[(4-fluorophenoxy)methyl]-1,3-oxazole-4-carbonitrile is 606949-35-3.
What is the molecular formula of 5-[(2-Chlorobenzyl)amino]-2-[(4-fluorophenoxy)methyl]-1,3-oxazole-4-carbonitrile?
The molecular formula of 5-[(2-Chlorobenzyl)amino]-2-[(4-fluorophenoxy)methyl]-1,3-oxazole-4-carbonitrile is C18H13ClFN3O2.
What is the molecular weight of 5-[(2-Chlorobenzyl)amino]-2-[(4-fluorophenoxy)methyl]-1,3-oxazole-4-carbonitrile?
The molecular weight of 5-[(2-Chlorobenzyl)amino]-2-[(4-fluorophenoxy)methyl]-1,3-oxazole-4-carbonitrile is 357.07 g/mol.
Where can I buy 5-[(2-Chlorobenzyl)amino]-2-[(4-fluorophenoxy)methyl]-1,3-oxazole-4-carbonitrile?
You can request a quote for 5-[(2-Chlorobenzyl)amino]-2-[(4-fluorophenoxy)methyl]-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-[(4-fluorophenoxy)methyl]-1,3-oxazole-4-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 5-[(2-Chlorobenzyl)amino]-2-[(4-fluorophenoxy)methyl]-1,3-oxazole-4-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.