1-(4-methylphenyl)-1-propanone O-(4-propoxybenzoyl)oxime
TL;DR: 1-(4-methylphenyl)-1-propanone O-(4-propoxybenzoyl)oxime (CAS 445258-10-6) is a chemical compound with molecular formula C20H23NO3 and molecular weight 325.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(E)-1-(4-methylphenyl)propylideneamino] 4-propoxybenzoate
Also Known As: 1-(4-methylphenyl)-1-propanone O-(4-propoxybenzoyl)oxime, (E)-1-(p-tolyl)propan-1-one O-(4-propoxybenzoyl) oxime, [(E)-1-(4-methylphenyl)propylideneamino] 4-propoxybenzoate, (1E)-2-(4-methylphenyl)-1-azabut-1-enyl 4-propoxybenzoate, ({[(1E)-1-(4-methylphenyl)propylidene]amino}oxy)(4-propoxyphenyl)methanone
| Molecular Formula | C20H23NO3 |
|---|---|
| Molecular Weight | 325.17 g/mol |
| LogP | 4.75492 |
| Topological Polar Surface Area | 47.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 325.1678 |
| Heavy Atoms | 24 |
| Complexity | 687.82886 |
Chemical Identifiers
| CAS Number | 445258-10-6 |
|---|---|
| SMILES | CCCOC1=CC=C(C=C1)C(=O)O/N=C(\CC)/C2=CC=C(C=C2)C |
Product Overview
1-(4-methylphenyl)-1-propanone O-(4-propoxybenzoyl)oxime (CAS 445258-10-6), with molecular formula C20H23NO3 and molecular weight 325.17 g/mol. IUPAC: [(E)-1-(4-methylphenyl)propylideneamino] 4-propoxybenzoate.
Chemical Property Profile of 1-(4-methylphenyl)-1-propanone O-(4-propoxybenzoyl)oxime
Property Insights of 1-(4-methylphenyl)-1-propanone O-(4-propoxybenzoyl)oxime
The XLogP value of 4.75492 indicates that 1-(4-methylphenyl)-1-propanone O-(4-propoxybenzoyl)oxime is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.89 Ų, 1-(4-methylphenyl)-1-propanone O-(4-propoxybenzoyl)oxime exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-methylphenyl)-1-propanone O-(4-propoxybenzoyl)oxime 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-(4-methylphenyl)-1-propanone O-(4-propoxybenzoyl)oxime?
The CAS number of 1-(4-methylphenyl)-1-propanone O-(4-propoxybenzoyl)oxime is 445258-10-6.
What is the molecular formula of 1-(4-methylphenyl)-1-propanone O-(4-propoxybenzoyl)oxime?
The molecular formula of 1-(4-methylphenyl)-1-propanone O-(4-propoxybenzoyl)oxime is C20H23NO3.
What is the molecular weight of 1-(4-methylphenyl)-1-propanone O-(4-propoxybenzoyl)oxime?
The molecular weight of 1-(4-methylphenyl)-1-propanone O-(4-propoxybenzoyl)oxime is 325.17 g/mol.
Where can I buy 1-(4-methylphenyl)-1-propanone O-(4-propoxybenzoyl)oxime?
You can request a quote for 1-(4-methylphenyl)-1-propanone O-(4-propoxybenzoyl)oxime directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-methylphenyl)-1-propanone O-(4-propoxybenzoyl)oxime?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-methylphenyl)-1-propanone O-(4-propoxybenzoyl)oxime and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.