5-(2-Chloro-benzylamino)-2-(2-methoxy-phenoxymethyl)-oxazole-4-carbonitrile
TL;DR: 5-(2-Chloro-benzylamino)-2-(2-methoxy-phenoxymethyl)-oxazole-4-carbonitrile (CAS 606949-51-3) is a chemical compound with molecular formula C19H16ClN3O3 and molecular weight 369.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(2-chlorophenyl)methylamino]-2-[(2-methoxyphenoxy)methyl]-1,3-oxazole-4-carbonitrile
Also Known As: BAS 05509812, 5-(2-Chloro-benzylamino)-2-(2-methoxy-phenoxymethyl)-oxazole-4-carbonitrile, 5-[(2-chlorophenyl)methylamino]-2-[(2-methoxyphenoxy)methyl]-1,3-oxazole-4-carbonitrile, 5-((2-chlorobenzyl)amino)-2-((2-methoxyphenoxy)methyl)oxazole-4-carbonitrile, 5-[(2-chlorobenzyl)amino]-2-[(2-methoxyphenoxy)methyl]-1,3-oxazole-4-carbonitrile
| Molecular Formula | C19H16ClN3O3 |
|---|---|
| Molecular Weight | 369.09 g/mol |
| LogP | 4.39938 |
| Topological Polar Surface Area | 80.31 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 369.088 |
| Heavy Atoms | 26 |
| Complexity | 933.7739 |
Chemical Identifiers
| CAS Number | 606949-51-3 |
|---|---|
| SMILES | COC1=CC=CC=C1OCC2=NC(=C(O2)NCC3=CC=CC=C3Cl)C#N |
Product Overview
5-(2-Chloro-benzylamino)-2-(2-methoxy-phenoxymethyl)-oxazole-4-carbonitrile (CAS 606949-51-3), with molecular formula C19H16ClN3O3 and molecular weight 369.09 g/mol. IUPAC: 5-[(2-chlorophenyl)methylamino]-2-[(2-methoxyphenoxy)methyl]-1,3-oxazole-4-carbonitrile.
Chemical Property Profile of 5-(2-Chloro-benzylamino)-2-(2-methoxy-phenoxymethyl)-oxazole-4-carbonitrile
Property Insights of 5-(2-Chloro-benzylamino)-2-(2-methoxy-phenoxymethyl)-oxazole-4-carbonitrile
The XLogP value of 4.39938 indicates that 5-(2-Chloro-benzylamino)-2-(2-methoxy-phenoxymethyl)-oxazole-4-carbonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.31 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(2-Chloro-benzylamino)-2-(2-methoxy-phenoxymethyl)-oxazole-4-carbonitrile. Following Lipinski's Rule of Five, 5-(2-Chloro-benzylamino)-2-(2-methoxy-phenoxymethyl)-oxazole-4-carbonitrile has 1 hydrogen bond donor(s) and 6 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-Chloro-benzylamino)-2-(2-methoxy-phenoxymethyl)-oxazole-4-carbonitrile?
The CAS number of 5-(2-Chloro-benzylamino)-2-(2-methoxy-phenoxymethyl)-oxazole-4-carbonitrile is 606949-51-3.
What is the molecular formula of 5-(2-Chloro-benzylamino)-2-(2-methoxy-phenoxymethyl)-oxazole-4-carbonitrile?
The molecular formula of 5-(2-Chloro-benzylamino)-2-(2-methoxy-phenoxymethyl)-oxazole-4-carbonitrile is C19H16ClN3O3.
What is the molecular weight of 5-(2-Chloro-benzylamino)-2-(2-methoxy-phenoxymethyl)-oxazole-4-carbonitrile?
The molecular weight of 5-(2-Chloro-benzylamino)-2-(2-methoxy-phenoxymethyl)-oxazole-4-carbonitrile is 369.09 g/mol.
Where can I buy 5-(2-Chloro-benzylamino)-2-(2-methoxy-phenoxymethyl)-oxazole-4-carbonitrile?
You can request a quote for 5-(2-Chloro-benzylamino)-2-(2-methoxy-phenoxymethyl)-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-Chloro-benzylamino)-2-(2-methoxy-phenoxymethyl)-oxazole-4-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 5-(2-Chloro-benzylamino)-2-(2-methoxy-phenoxymethyl)-oxazole-4-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.