![1-[2-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-5-methoxy-4-methylphenyl]ethanone structure](/static/products/820/82045-52-1.png)
1-[2-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-5-methoxy-4-methylphenyl]ethanone
TL;DR: 1-[2-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-5-methoxy-4-methylphenyl]ethanone (CAS 82045-52-1) is a chemical compound with molecular formula C15H19NO3 and molecular weight 261.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[2-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-5-methoxy-4-methylphenyl]ethanone
Also Known As: 1-[2-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-5-methoxy-4-methylphenyl]ethanone, 1-[2-(4,4-Dimethyl-4,5-dihydro-1,3-oxazol-2-yl)-5-methoxy-4-methylphenyl]ethan-1-one
| Molecular Formula | C15H19NO3 |
|---|---|
| Molecular Weight | 261.14 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 47.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 261.1365 |
| Heavy Atoms | 19 |
| Complexity | 389.0 |
Chemical Identifiers
| CAS Number | 82045-52-1 |
|---|---|
| SMILES | CC1=CC(=C(C=C1OC)C(=O)C)C2=NC(CO2)(C)C |
| InChIKey | MJFLBKOTBLHWQF-UHFFFAOYSA-N |
Product Overview
1-[2-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-5-methoxy-4-methylphenyl]ethanone (CAS 82045-52-1), with molecular formula C15H19NO3 and molecular weight 261.14 g/mol. IUPAC: 1-[2-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-5-methoxy-4-methylphenyl]ethanone.
Chemical Property Profile of 1-[2-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-5-methoxy-4-methylphenyl]ethanone
Property Insights of 1-[2-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-5-methoxy-4-methylphenyl]ethanone
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[2-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-5-methoxy-4-methylphenyl]ethanone. With a topological polar surface area (TPSA) of 47.9 Ų, 1-[2-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-5-methoxy-4-methylphenyl]ethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[2-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-5-methoxy-4-methylphenyl]ethanone 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 1-[2-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-5-methoxy-4-methylphenyl]ethanone?
The CAS number of 1-[2-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-5-methoxy-4-methylphenyl]ethanone is 82045-52-1.
What is the molecular formula of 1-[2-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-5-methoxy-4-methylphenyl]ethanone?
The molecular formula of 1-[2-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-5-methoxy-4-methylphenyl]ethanone is C15H19NO3.
What is the molecular weight of 1-[2-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-5-methoxy-4-methylphenyl]ethanone?
The molecular weight of 1-[2-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-5-methoxy-4-methylphenyl]ethanone is 261.14 g/mol.
Where can I buy 1-[2-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-5-methoxy-4-methylphenyl]ethanone?
You can request a quote for 1-[2-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-5-methoxy-4-methylphenyl]ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[2-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-5-methoxy-4-methylphenyl]ethanone?
Yes, KEHONG BIO provides custom synthesis services for 1-[2-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-5-methoxy-4-methylphenyl]ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.