![5-[(2-Chlorophenyl)methylamino]-2-(4-methoxyphenyl)-4-oxazolecarbonitrile structure](/static/products/6136/613651-33-5.webp)
5-[(2-Chlorophenyl)methylamino]-2-(4-methoxyphenyl)-4-oxazolecarbonitrile
TL;DR: 5-[(2-Chlorophenyl)methylamino]-2-(4-methoxyphenyl)-4-oxazolecarbonitrile (CAS 613651-33-5) is a chemical compound with molecular formula C18H14ClN3O2 and molecular weight 339.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(2-chlorophenyl)methylamino]-2-(4-methoxyphenyl)-1,3-oxazole-4-carbonitrile
Also Known As: 5-[(2-chlorophenyl)methylamino]-2-(4-methoxyphenyl)-1,3-oxazole-4-carbonitrile, 5-[(2-chlorophenyl)methylamino]-2-(4-methoxyphenyl)-4-oxazolecarbonitrile, 5-[(2-chlorobenzyl)amino]-2-(4-methoxyphenyl)-1,3-oxazole-4-carbonitrile, 5-((2-chlorobenzyl)amino)-2-(4-methoxyphenyl)oxazole-4-carbonitrile
| Molecular Formula | C18H14ClN3O2 |
|---|---|
| Molecular Weight | 339.08 g/mol |
| LogP | 4.48738 |
| Topological Polar Surface Area | 71.08 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 339.07745 |
| Heavy Atoms | 24 |
| Complexity | 882.02466 |
Chemical Identifiers
| CAS Number | 613651-33-5 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2=NC(=C(O2)NCC3=CC=CC=C3Cl)C#N |
Product Overview
5-[(2-Chlorophenyl)methylamino]-2-(4-methoxyphenyl)-4-oxazolecarbonitrile (CAS 613651-33-5), with molecular formula C18H14ClN3O2 and molecular weight 339.08 g/mol. IUPAC: 5-[(2-chlorophenyl)methylamino]-2-(4-methoxyphenyl)-1,3-oxazole-4-carbonitrile.
Chemical Property Profile of 5-[(2-Chlorophenyl)methylamino]-2-(4-methoxyphenyl)-4-oxazolecarbonitrile
Property Insights of 5-[(2-Chlorophenyl)methylamino]-2-(4-methoxyphenyl)-4-oxazolecarbonitrile
The XLogP value of 4.48738 indicates that 5-[(2-Chlorophenyl)methylamino]-2-(4-methoxyphenyl)-4-oxazolecarbonitrile 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-Chlorophenyl)methylamino]-2-(4-methoxyphenyl)-4-oxazolecarbonitrile. Following Lipinski's Rule of Five, 5-[(2-Chlorophenyl)methylamino]-2-(4-methoxyphenyl)-4-oxazolecarbonitrile 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-Chlorophenyl)methylamino]-2-(4-methoxyphenyl)-4-oxazolecarbonitrile?
The CAS number of 5-[(2-Chlorophenyl)methylamino]-2-(4-methoxyphenyl)-4-oxazolecarbonitrile is 613651-33-5.
What is the molecular formula of 5-[(2-Chlorophenyl)methylamino]-2-(4-methoxyphenyl)-4-oxazolecarbonitrile?
The molecular formula of 5-[(2-Chlorophenyl)methylamino]-2-(4-methoxyphenyl)-4-oxazolecarbonitrile is C18H14ClN3O2.
What is the molecular weight of 5-[(2-Chlorophenyl)methylamino]-2-(4-methoxyphenyl)-4-oxazolecarbonitrile?
The molecular weight of 5-[(2-Chlorophenyl)methylamino]-2-(4-methoxyphenyl)-4-oxazolecarbonitrile is 339.08 g/mol.
Where can I buy 5-[(2-Chlorophenyl)methylamino]-2-(4-methoxyphenyl)-4-oxazolecarbonitrile?
You can request a quote for 5-[(2-Chlorophenyl)methylamino]-2-(4-methoxyphenyl)-4-oxazolecarbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-[(2-Chlorophenyl)methylamino]-2-(4-methoxyphenyl)-4-oxazolecarbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 5-[(2-Chlorophenyl)methylamino]-2-(4-methoxyphenyl)-4-oxazolecarbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.