![5-[(2-Chlorobenzyl)amino]-2-(naphthalen-1-yl)-1,3-oxazole-4-carbonitrile structure](/static/products/848/848735-74-0.png)
5-[(2-Chlorobenzyl)amino]-2-(naphthalen-1-yl)-1,3-oxazole-4-carbonitrile
TL;DR: 5-[(2-Chlorobenzyl)amino]-2-(naphthalen-1-yl)-1,3-oxazole-4-carbonitrile (CAS 848735-74-0) is a chemical compound with molecular formula C21H14ClN3O and molecular weight 359.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(2-chlorophenyl)methylamino]-2-naphthalen-1-yl-1,3-oxazole-4-carbonitrile
Also Known As: 5-((2-chlorobenzyl)amino)-2-(naphthalen-1-yl)oxazole-4-carbonitrile, 5-[(2-chlorobenzyl)amino]-2-(naphthalen-1-yl)-1,3-oxazole-4-carbonitrile, 5-[(2-chlorophenyl)methylamino]-2-naphthalen-1-yl-1,3-oxazole-4-carbonitrile, 5-{[(2-CHLOROPHENYL)METHYL]AMINO}-2-(NAPHTHALEN-1-YL)-1,3-OXAZOLE-4-CARBONITRILE
| Molecular Formula | C21H14ClN3O |
|---|---|
| Molecular Weight | 359.08 g/mol |
| LogP | 5.63198 |
| Topological Polar Surface Area | 61.85 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 359.08255 |
| Heavy Atoms | 26 |
| Complexity | 1122.2667 |
Chemical Identifiers
| CAS Number | 848735-74-0 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=CC=C2C3=NC(=C(O3)NCC4=CC=CC=C4Cl)C#N |
Product Overview
5-[(2-Chlorobenzyl)amino]-2-(naphthalen-1-yl)-1,3-oxazole-4-carbonitrile (CAS 848735-74-0), with molecular formula C21H14ClN3O and molecular weight 359.08 g/mol. IUPAC: 5-[(2-chlorophenyl)methylamino]-2-naphthalen-1-yl-1,3-oxazole-4-carbonitrile.
Chemical Property Profile of 5-[(2-Chlorobenzyl)amino]-2-(naphthalen-1-yl)-1,3-oxazole-4-carbonitrile
Property Insights of 5-[(2-Chlorobenzyl)amino]-2-(naphthalen-1-yl)-1,3-oxazole-4-carbonitrile
The XLogP value of 5.63198 indicates that 5-[(2-Chlorobenzyl)amino]-2-(naphthalen-1-yl)-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-(naphthalen-1-yl)-1,3-oxazole-4-carbonitrile. Following Lipinski's Rule of Five, 5-[(2-Chlorobenzyl)amino]-2-(naphthalen-1-yl)-1,3-oxazole-4-carbonitrile has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5-[(2-Chlorobenzyl)amino]-2-(naphthalen-1-yl)-1,3-oxazole-4-carbonitrile?
The CAS number of 5-[(2-Chlorobenzyl)amino]-2-(naphthalen-1-yl)-1,3-oxazole-4-carbonitrile is 848735-74-0.
What is the molecular formula of 5-[(2-Chlorobenzyl)amino]-2-(naphthalen-1-yl)-1,3-oxazole-4-carbonitrile?
The molecular formula of 5-[(2-Chlorobenzyl)amino]-2-(naphthalen-1-yl)-1,3-oxazole-4-carbonitrile is C21H14ClN3O.
What is the molecular weight of 5-[(2-Chlorobenzyl)amino]-2-(naphthalen-1-yl)-1,3-oxazole-4-carbonitrile?
The molecular weight of 5-[(2-Chlorobenzyl)amino]-2-(naphthalen-1-yl)-1,3-oxazole-4-carbonitrile is 359.08 g/mol.
Where can I buy 5-[(2-Chlorobenzyl)amino]-2-(naphthalen-1-yl)-1,3-oxazole-4-carbonitrile?
You can request a quote for 5-[(2-Chlorobenzyl)amino]-2-(naphthalen-1-yl)-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-(naphthalen-1-yl)-1,3-oxazole-4-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 5-[(2-Chlorobenzyl)amino]-2-(naphthalen-1-yl)-1,3-oxazole-4-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.