![diethyl 2-[4-(acetyloxy)phenyl]-4,6-dioxo-5-(phenylcarbamoyl)cyclohexane-1,3-dicarboxylate structure](/static/products/1023/10236-10-9.webp)
diethyl 2-[4-(acetyloxy)phenyl]-4,6-dioxo-5-(phenylcarbamoyl)cyclohexane-1,3-dicarboxylate
TL;DR: diethyl 2-[4-(acetyloxy)phenyl]-4,6-dioxo-5-(phenylcarbamoyl)cyclohexane-1,3-dicarboxylate (CAS 10236-10-9) is a chemical compound with molecular formula C27H27NO9 and molecular weight 509.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl 2-(4-acetyloxyphenyl)-4,6-dioxo-5-(phenylcarbamoyl)cyclohexane-1,3-dicarboxylate
Also Known As: diethyl 2-[4-(acetyloxy)phenyl]-4,6-dioxo-5-(phenylcarbamoyl)cyclohexane-1,3-dicarboxylate, diethyl 2-(4-acetyloxyphenyl)-4,6-dioxo-5-(phenylcarbamoyl)c, diethyl 2-(4-acetyloxyphenyl)-4,6-dioxo-5-(phenylcarbamoyl)cyclohexane-1,3-dicarboxylate, 5-(p-Acetoxyphenyl)-2-phenylcarbamoyl-4,6-dicarbethoxy-1,3-cyclohexandion, Diethyl 2-(4-acetoxyphenyl)-4,6-dioxo-5-(phenylcarbamoyl)cyclohexane-1,3-dicarboxylate
| Molecular Formula | C27H27NO9 |
|---|---|
| Molecular Weight | 509.17 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 142.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 11 |
| Exact Mass | 509.16858 |
| Heavy Atoms | 37 |
| Complexity | 848.0 |
Chemical Identifiers
| CAS Number | 10236-10-9 |
|---|---|
| SMILES | CCOC(=O)C1C(C(C(=O)C(C1=O)C(=O)NC2=CC=CC=C2)C(=O)OCC)C3=CC=C(C=C3)OC(=O)C |
| InChIKey | BUPREBNYEZJLMM-UHFFFAOYSA-N |
Product Overview
diethyl 2-[4-(acetyloxy)phenyl]-4,6-dioxo-5-(phenylcarbamoyl)cyclohexane-1,3-dicarboxylate (CAS 10236-10-9), with molecular formula C27H27NO9 and molecular weight 509.17 g/mol. IUPAC: diethyl 2-(4-acetyloxyphenyl)-4,6-dioxo-5-(phenylcarbamoyl)cyclohexane-1,3-dicarboxylate.
Chemical Property Profile of diethyl 2-[4-(acetyloxy)phenyl]-4,6-dioxo-5-(phenylcarbamoyl)cyclohexane-1,3-dicarboxylate
Property Insights of diethyl 2-[4-(acetyloxy)phenyl]-4,6-dioxo-5-(phenylcarbamoyl)cyclohexane-1,3-dicarboxylate
The XLogP value of 3.2 indicates that diethyl 2-[4-(acetyloxy)phenyl]-4,6-dioxo-5-(phenylcarbamoyl)cyclohexane-1,3-dicarboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 142.0 Ų indicates high polarity, suggesting diethyl 2-[4-(acetyloxy)phenyl]-4,6-dioxo-5-(phenylcarbamoyl)cyclohexane-1,3-dicarboxylate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, diethyl 2-[4-(acetyloxy)phenyl]-4,6-dioxo-5-(phenylcarbamoyl)cyclohexane-1,3-dicarboxylate has 1 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of diethyl 2-[4-(acetyloxy)phenyl]-4,6-dioxo-5-(phenylcarbamoyl)cyclohexane-1,3-dicarboxylate?
The CAS number of diethyl 2-[4-(acetyloxy)phenyl]-4,6-dioxo-5-(phenylcarbamoyl)cyclohexane-1,3-dicarboxylate is 10236-10-9.
What is the molecular formula of diethyl 2-[4-(acetyloxy)phenyl]-4,6-dioxo-5-(phenylcarbamoyl)cyclohexane-1,3-dicarboxylate?
The molecular formula of diethyl 2-[4-(acetyloxy)phenyl]-4,6-dioxo-5-(phenylcarbamoyl)cyclohexane-1,3-dicarboxylate is C27H27NO9.
What is the molecular weight of diethyl 2-[4-(acetyloxy)phenyl]-4,6-dioxo-5-(phenylcarbamoyl)cyclohexane-1,3-dicarboxylate?
The molecular weight of diethyl 2-[4-(acetyloxy)phenyl]-4,6-dioxo-5-(phenylcarbamoyl)cyclohexane-1,3-dicarboxylate is 509.17 g/mol.
Where can I buy diethyl 2-[4-(acetyloxy)phenyl]-4,6-dioxo-5-(phenylcarbamoyl)cyclohexane-1,3-dicarboxylate?
You can request a quote for diethyl 2-[4-(acetyloxy)phenyl]-4,6-dioxo-5-(phenylcarbamoyl)cyclohexane-1,3-dicarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for diethyl 2-[4-(acetyloxy)phenyl]-4,6-dioxo-5-(phenylcarbamoyl)cyclohexane-1,3-dicarboxylate?
Yes, KEHONG BIO provides custom synthesis services for diethyl 2-[4-(acetyloxy)phenyl]-4,6-dioxo-5-(phenylcarbamoyl)cyclohexane-1,3-dicarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.