4-(2-Methoxybenzylidene)-2-methyloxazol-5(4H)-one
TL;DR: 4-(2-Methoxybenzylidene)-2-methyloxazol-5(4H)-one (CAS 74169-01-0) is a chemical compound with molecular formula C12H11NO3 and molecular weight 217.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(2-methoxyphenyl)methylidene]-2-methyl-1,3-oxazol-5-one
Also Known As: 4-(2-Methoxybenzylidene)-2-methyloxazol-5(4H)-one, NCI60_007381, 5(4H)-Oxazolone, 4-[(2-methoxyphenyl)methylene]-2-methyl-, 4-(2'-methoxybenzylidene)-2-methyl-4H-oxazol-5-one, (E)-4-(2-methoxybenzylidene)-2-methyloxazol-5(4H)-one
| Molecular Formula | C12H11NO3 |
|---|---|
| Molecular Weight | 217.07 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 47.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 217.0739 |
| Heavy Atoms | 16 |
| Complexity | 346.0 |
Chemical Identifiers
| CAS Number | 74169-01-0 |
|---|---|
| SMILES | CC1=NC(=CC2=CC=CC=C2OC)C(=O)O1 |
| InChIKey | HSKVPAFMAZDKCS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-(2-Methoxybenzylidene)-2-methyloxazol-5(4H)-one (CAS 74169-01-0), with molecular formula C12H11NO3 and molecular weight 217.07 g/mol. IUPAC: 4-[(2-methoxyphenyl)methylidene]-2-methyl-1,3-oxazol-5-one.
Chemical Property Profile of 4-(2-Methoxybenzylidene)-2-methyloxazol-5(4H)-one
Property Insights of 4-(2-Methoxybenzylidene)-2-methyloxazol-5(4H)-one
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(2-Methoxybenzylidene)-2-methyloxazol-5(4H)-one. With a topological polar surface area (TPSA) of 47.9 Ų, 4-(2-Methoxybenzylidene)-2-methyloxazol-5(4H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(2-Methoxybenzylidene)-2-methyloxazol-5(4H)-one has 0 hydrogen bond donor(s) and 4 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 4-(2-Methoxybenzylidene)-2-methyloxazol-5(4H)-one?
The CAS number of 4-(2-Methoxybenzylidene)-2-methyloxazol-5(4H)-one is 74169-01-0.
What is the molecular formula of 4-(2-Methoxybenzylidene)-2-methyloxazol-5(4H)-one?
The molecular formula of 4-(2-Methoxybenzylidene)-2-methyloxazol-5(4H)-one is C12H11NO3.
What is the molecular weight of 4-(2-Methoxybenzylidene)-2-methyloxazol-5(4H)-one?
The molecular weight of 4-(2-Methoxybenzylidene)-2-methyloxazol-5(4H)-one is 217.07 g/mol.
Where can I buy 4-(2-Methoxybenzylidene)-2-methyloxazol-5(4H)-one?
You can request a quote for 4-(2-Methoxybenzylidene)-2-methyloxazol-5(4H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(2-Methoxybenzylidene)-2-methyloxazol-5(4H)-one?
Yes, KEHONG BIO provides custom synthesis services for 4-(2-Methoxybenzylidene)-2-methyloxazol-5(4H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.