![5-[(2-Chlorophenyl)methylamino]-2-(3,4-dimethoxyphenyl)-4-oxazolecarbonitrile structure](/static/products/847/847242-75-5.png)
5-[(2-Chlorophenyl)methylamino]-2-(3,4-dimethoxyphenyl)-4-oxazolecarbonitrile
TL;DR: 5-[(2-Chlorophenyl)methylamino]-2-(3,4-dimethoxyphenyl)-4-oxazolecarbonitrile (CAS 847242-75-5) 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-(3,4-dimethoxyphenyl)-1,3-oxazole-4-carbonitrile
Also Known As: 5-[(2-chlorophenyl)methylamino]-2-(3,4-dimethoxyphenyl)-4-oxazolecarbonitrile, 5-[(2-chlorophenyl)methylamino]-2-(3,4-dimethoxyphenyl)-1,3-oxazole-4-carbonitrile, 5-((2-chlorobenzyl)amino)-2-(3,4-dimethoxyphenyl)oxazole-4-carbonitrile, 5-[(2-chlorobenzyl)amino]-2-(3,4-dimethoxyphenyl)-1,3-oxazole-4-carbonitrile
| Molecular Formula | C19H16ClN3O3 |
|---|---|
| Molecular Weight | 369.09 g/mol |
| LogP | 5.0 |
| Topological Polar Surface Area | 80.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 369.088 |
| Heavy Atoms | 26 |
| Complexity | 500.0 |
Chemical Identifiers
| CAS Number | 847242-75-5 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C2=NC(=C(O2)NCC3=CC=CC=C3Cl)C#N)OC |
| InChIKey | YSMQLDBKVHIHFD-UHFFFAOYSA-N |
Product Overview
5-[(2-Chlorophenyl)methylamino]-2-(3,4-dimethoxyphenyl)-4-oxazolecarbonitrile (CAS 847242-75-5), with molecular formula C19H16ClN3O3 and molecular weight 369.09 g/mol. IUPAC: 5-[(2-chlorophenyl)methylamino]-2-(3,4-dimethoxyphenyl)-1,3-oxazole-4-carbonitrile.
Chemical Property Profile of 5-[(2-Chlorophenyl)methylamino]-2-(3,4-dimethoxyphenyl)-4-oxazolecarbonitrile
Property Insights of 5-[(2-Chlorophenyl)methylamino]-2-(3,4-dimethoxyphenyl)-4-oxazolecarbonitrile
The XLogP value of 5.0 indicates that 5-[(2-Chlorophenyl)methylamino]-2-(3,4-dimethoxyphenyl)-4-oxazolecarbonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-[(2-Chlorophenyl)methylamino]-2-(3,4-dimethoxyphenyl)-4-oxazolecarbonitrile. Following Lipinski's Rule of Five, 5-[(2-Chlorophenyl)methylamino]-2-(3,4-dimethoxyphenyl)-4-oxazolecarbonitrile 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-Chlorophenyl)methylamino]-2-(3,4-dimethoxyphenyl)-4-oxazolecarbonitrile?
The CAS number of 5-[(2-Chlorophenyl)methylamino]-2-(3,4-dimethoxyphenyl)-4-oxazolecarbonitrile is 847242-75-5.
What is the molecular formula of 5-[(2-Chlorophenyl)methylamino]-2-(3,4-dimethoxyphenyl)-4-oxazolecarbonitrile?
The molecular formula of 5-[(2-Chlorophenyl)methylamino]-2-(3,4-dimethoxyphenyl)-4-oxazolecarbonitrile is C19H16ClN3O3.
What is the molecular weight of 5-[(2-Chlorophenyl)methylamino]-2-(3,4-dimethoxyphenyl)-4-oxazolecarbonitrile?
The molecular weight of 5-[(2-Chlorophenyl)methylamino]-2-(3,4-dimethoxyphenyl)-4-oxazolecarbonitrile is 369.09 g/mol.
Where can I buy 5-[(2-Chlorophenyl)methylamino]-2-(3,4-dimethoxyphenyl)-4-oxazolecarbonitrile?
You can request a quote for 5-[(2-Chlorophenyl)methylamino]-2-(3,4-dimethoxyphenyl)-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-(3,4-dimethoxyphenyl)-4-oxazolecarbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 5-[(2-Chlorophenyl)methylamino]-2-(3,4-dimethoxyphenyl)-4-oxazolecarbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.