dimethyl (2E)-2-(3,5-dimethyl-4-oxo-2,6-diphenylpiperidin-1-yl)but-2-enedioate
TL;DR: dimethyl (2E)-2-(3,5-dimethyl-4-oxo-2,6-diphenylpiperidin-1-yl)but-2-enedioate (CAS 1008973-93-0) is a chemical compound with molecular formula C25H27NO5 and molecular weight 421.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl (E)-2-(3,5-dimethyl-4-oxo-2,6-diphenylpiperidin-1-yl)but-2-enedioate
Also Known As: dimethyl 2-(3,5-dimethyl-4-oxo-2,6-diphenylpiperidin-1-yl)maleate, dimethyl (2E)-2-(3,5-dimethyl-4-oxo-2,6-diphenylpiperidin-1-yl)but-2-enedioate, dimethyl (E)-2-(3,5-dimethyl-4-oxo-2,6-diphenylpiperidin-1-yl)but-2-enedioate
| Molecular Formula | C25H27NO5 |
|---|---|
| Molecular Weight | 421.19 g/mol |
| LogP | 3.8558 |
| Topological Polar Surface Area | 72.91 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 421.18893 |
| Heavy Atoms | 31 |
| Complexity | 914.4216 |
Chemical Identifiers
| CAS Number | 1008973-93-0 |
|---|---|
| SMILES | CC1C(N(C(C(C1=O)C)C2=CC=CC=C2)/C(=C/C(=O)OC)/C(=O)OC)C3=CC=CC=C3 |
Product Overview
dimethyl (2E)-2-(3,5-dimethyl-4-oxo-2,6-diphenylpiperidin-1-yl)but-2-enedioate (CAS 1008973-93-0), with molecular formula C25H27NO5 and molecular weight 421.19 g/mol. IUPAC: dimethyl (E)-2-(3,5-dimethyl-4-oxo-2,6-diphenylpiperidin-1-yl)but-2-enedioate.
Chemical Property Profile of dimethyl (2E)-2-(3,5-dimethyl-4-oxo-2,6-diphenylpiperidin-1-yl)but-2-enedioate
Property Insights of dimethyl (2E)-2-(3,5-dimethyl-4-oxo-2,6-diphenylpiperidin-1-yl)but-2-enedioate
The XLogP value of 3.8558 indicates that dimethyl (2E)-2-(3,5-dimethyl-4-oxo-2,6-diphenylpiperidin-1-yl)but-2-enedioate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.91 Ų falls within the moderate polarity range, balancing permeability and solubility for dimethyl (2E)-2-(3,5-dimethyl-4-oxo-2,6-diphenylpiperidin-1-yl)but-2-enedioate. Following Lipinski's Rule of Five, dimethyl (2E)-2-(3,5-dimethyl-4-oxo-2,6-diphenylpiperidin-1-yl)but-2-enedioate 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 dimethyl (2E)-2-(3,5-dimethyl-4-oxo-2,6-diphenylpiperidin-1-yl)but-2-enedioate?
The CAS number of dimethyl (2E)-2-(3,5-dimethyl-4-oxo-2,6-diphenylpiperidin-1-yl)but-2-enedioate is 1008973-93-0.
What is the molecular formula of dimethyl (2E)-2-(3,5-dimethyl-4-oxo-2,6-diphenylpiperidin-1-yl)but-2-enedioate?
The molecular formula of dimethyl (2E)-2-(3,5-dimethyl-4-oxo-2,6-diphenylpiperidin-1-yl)but-2-enedioate is C25H27NO5.
What is the molecular weight of dimethyl (2E)-2-(3,5-dimethyl-4-oxo-2,6-diphenylpiperidin-1-yl)but-2-enedioate?
The molecular weight of dimethyl (2E)-2-(3,5-dimethyl-4-oxo-2,6-diphenylpiperidin-1-yl)but-2-enedioate is 421.19 g/mol.
Where can I buy dimethyl (2E)-2-(3,5-dimethyl-4-oxo-2,6-diphenylpiperidin-1-yl)but-2-enedioate?
You can request a quote for dimethyl (2E)-2-(3,5-dimethyl-4-oxo-2,6-diphenylpiperidin-1-yl)but-2-enedioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for dimethyl (2E)-2-(3,5-dimethyl-4-oxo-2,6-diphenylpiperidin-1-yl)but-2-enedioate?
Yes, KEHONG BIO provides custom synthesis services for dimethyl (2E)-2-(3,5-dimethyl-4-oxo-2,6-diphenylpiperidin-1-yl)but-2-enedioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.