![2-[4,5-dihydro-5-3- isoxazol-5-yl]-1-phenylethanone structure](/static/products/5633/56335-89-8.webp)
2-[4,5-dihydro-5-3- isoxazol-5-yl]-1-phenylethanone
TL;DR: 2-[4,5-dihydro-5-3- isoxazol-5-yl]-1-phenylethanone (CAS 56335-89-8) is a chemical compound with molecular formula C25H23NO3 and molecular weight 385.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[5-(4-methoxyphenyl)-3-(4-methylphenyl)-4H-1,2-oxazol-5-yl]-1-phenylethanone
Also Known As: 2-[4,5-dihydro-5-3- isoxazol-5-yl]-1-phenylethanone, 2-[4,5-Dihydro-5- -3- isoxazol-5-yl]-1-phenylethanone, Ethanone, 2-[4,5-dihydro-5-(4-methoxyphenyl)-3-(4-methylphenyl)-5-isoxazolyl]-1-phenyl-, 2-[4,5-Dihydro-5-(4-methoxyphenyl)-3-(4-methylphenyl)isoxazol-5-yl ]-1-phenylethanone, 2-[4,5-Dihydro-5-(4-methoxyphenyl)-3-(4-methylphenyl)isoxazol-5-yl]-1-phenylethanone
| Molecular Formula | C25H23NO3 |
|---|---|
| Molecular Weight | 385.17 g/mol |
| LogP | 4.8 |
| Topological Polar Surface Area | 47.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 385.1678 |
| Heavy Atoms | 29 |
| Complexity | 581.0 |
Chemical Identifiers
| CAS Number | 56335-89-8 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2=NOC(C2)(CC(=O)C3=CC=CC=C3)C4=CC=C(C=C4)OC |
| InChIKey | KGHYCKNFMSFAPS-UHFFFAOYSA-N |
Product Overview
2-[4,5-dihydro-5-3- isoxazol-5-yl]-1-phenylethanone (CAS 56335-89-8), with molecular formula C25H23NO3 and molecular weight 385.17 g/mol. IUPAC: 2-[5-(4-methoxyphenyl)-3-(4-methylphenyl)-4H-1,2-oxazol-5-yl]-1-phenylethanone.
Chemical Property Profile of 2-[4,5-dihydro-5-3- isoxazol-5-yl]-1-phenylethanone
Property Insights of 2-[4,5-dihydro-5-3- isoxazol-5-yl]-1-phenylethanone
The XLogP value of 4.8 indicates that 2-[4,5-dihydro-5-3- isoxazol-5-yl]-1-phenylethanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.9 Ų, 2-[4,5-dihydro-5-3- isoxazol-5-yl]-1-phenylethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[4,5-dihydro-5-3- isoxazol-5-yl]-1-phenylethanone 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 2-[4,5-dihydro-5-3- isoxazol-5-yl]-1-phenylethanone?
The CAS number of 2-[4,5-dihydro-5-3- isoxazol-5-yl]-1-phenylethanone is 56335-89-8.
What is the molecular formula of 2-[4,5-dihydro-5-3- isoxazol-5-yl]-1-phenylethanone?
The molecular formula of 2-[4,5-dihydro-5-3- isoxazol-5-yl]-1-phenylethanone is C25H23NO3.
What is the molecular weight of 2-[4,5-dihydro-5-3- isoxazol-5-yl]-1-phenylethanone?
The molecular weight of 2-[4,5-dihydro-5-3- isoxazol-5-yl]-1-phenylethanone is 385.17 g/mol.
Where can I buy 2-[4,5-dihydro-5-3- isoxazol-5-yl]-1-phenylethanone?
You can request a quote for 2-[4,5-dihydro-5-3- isoxazol-5-yl]-1-phenylethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[4,5-dihydro-5-3- isoxazol-5-yl]-1-phenylethanone?
Yes, KEHONG BIO provides custom synthesis services for 2-[4,5-dihydro-5-3- isoxazol-5-yl]-1-phenylethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.