1-methyl-2-(4-methylphenyl)-2-oxoethyl 2-(3-acetylphenyl)-1,3-dioxoisoindoline-5-carboxylate
TL;DR: 1-methyl-2-(4-methylphenyl)-2-oxoethyl 2-(3-acetylphenyl)-1,3-dioxoisoindoline-5-carboxylate (CAS 355431-30-0) is a chemical compound with molecular formula C27H21NO6 and molecular weight 455.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[1-(4-methylphenyl)-1-oxopropan-2-yl] 2-(3-acetylphenyl)-1,3-dioxoisoindole-5-carboxylate
Also Known As: 1-methyl-2-(4-methylphenyl)-2-oxoethyl 2-(3-acetylphenyl)-1,3-dioxoisoindoline-5-carboxylate, AN-919/15330005, 1-(4-methylphenyl)-1-oxopropan-2-yl 2-(3-acetylphenyl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylate, [1-(4-methylphenyl)-1-oxopropan-2-yl] 2-(3-acetylphenyl)-1,3-dioxoisoindole-5-carboxylate
| Molecular Formula | C27H21NO6 |
|---|---|
| Molecular Weight | 455.14 g/mol |
| LogP | 4.42642 |
| Topological Polar Surface Area | 97.82 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 455.1369 |
| Heavy Atoms | 34 |
| Complexity | 1355.7882 |
Chemical Identifiers
| CAS Number | 355431-30-0 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C(=O)C(C)OC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)C4=CC=CC(=C4)C(=O)C |
Product Overview
1-methyl-2-(4-methylphenyl)-2-oxoethyl 2-(3-acetylphenyl)-1,3-dioxoisoindoline-5-carboxylate (CAS 355431-30-0), with molecular formula C27H21NO6 and molecular weight 455.14 g/mol. IUPAC: [1-(4-methylphenyl)-1-oxopropan-2-yl] 2-(3-acetylphenyl)-1,3-dioxoisoindole-5-carboxylate.
Chemical Property Profile of 1-methyl-2-(4-methylphenyl)-2-oxoethyl 2-(3-acetylphenyl)-1,3-dioxoisoindoline-5-carboxylate
Property Insights of 1-methyl-2-(4-methylphenyl)-2-oxoethyl 2-(3-acetylphenyl)-1,3-dioxoisoindoline-5-carboxylate
The XLogP value of 4.42642 indicates that 1-methyl-2-(4-methylphenyl)-2-oxoethyl 2-(3-acetylphenyl)-1,3-dioxoisoindoline-5-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 97.82 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-methyl-2-(4-methylphenyl)-2-oxoethyl 2-(3-acetylphenyl)-1,3-dioxoisoindoline-5-carboxylate. Following Lipinski's Rule of Five, 1-methyl-2-(4-methylphenyl)-2-oxoethyl 2-(3-acetylphenyl)-1,3-dioxoisoindoline-5-carboxylate has 0 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 1-methyl-2-(4-methylphenyl)-2-oxoethyl 2-(3-acetylphenyl)-1,3-dioxoisoindoline-5-carboxylate?
The CAS number of 1-methyl-2-(4-methylphenyl)-2-oxoethyl 2-(3-acetylphenyl)-1,3-dioxoisoindoline-5-carboxylate is 355431-30-0.
What is the molecular formula of 1-methyl-2-(4-methylphenyl)-2-oxoethyl 2-(3-acetylphenyl)-1,3-dioxoisoindoline-5-carboxylate?
The molecular formula of 1-methyl-2-(4-methylphenyl)-2-oxoethyl 2-(3-acetylphenyl)-1,3-dioxoisoindoline-5-carboxylate is C27H21NO6.
What is the molecular weight of 1-methyl-2-(4-methylphenyl)-2-oxoethyl 2-(3-acetylphenyl)-1,3-dioxoisoindoline-5-carboxylate?
The molecular weight of 1-methyl-2-(4-methylphenyl)-2-oxoethyl 2-(3-acetylphenyl)-1,3-dioxoisoindoline-5-carboxylate is 455.14 g/mol.
Where can I buy 1-methyl-2-(4-methylphenyl)-2-oxoethyl 2-(3-acetylphenyl)-1,3-dioxoisoindoline-5-carboxylate?
You can request a quote for 1-methyl-2-(4-methylphenyl)-2-oxoethyl 2-(3-acetylphenyl)-1,3-dioxoisoindoline-5-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-methyl-2-(4-methylphenyl)-2-oxoethyl 2-(3-acetylphenyl)-1,3-dioxoisoindoline-5-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for 1-methyl-2-(4-methylphenyl)-2-oxoethyl 2-(3-acetylphenyl)-1,3-dioxoisoindoline-5-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.