Diethyl 1,2,5-triphenyl-2,5-dihydropyrrole-3,4-dicarboxylate
TL;DR: Diethyl 1,2,5-triphenyl-2,5-dihydropyrrole-3,4-dicarboxylate (CAS 33567-56-5) is a chemical compound with molecular formula C28H27NO4 and molecular weight 441.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl 1,2,5-triphenyl-2,5-dihydropyrrole-3,4-dicarboxylate
Also Known As: diethyl 1,2,5-triphenyl-2,5-dihydropyrrole-3,4-dicarboxylate, diethyl 1,2,5-triphenyl-2,5-dihydro-1h-pyrrole-3,4-dicarboxylate, 1,2,5-Triphenyl-3,4-dicarbethoxy-3-pyrrolin, RefChem:337723
| Molecular Formula | C28H27NO4 |
|---|---|
| Molecular Weight | 441.19 g/mol |
| LogP | 5.5 |
| Topological Polar Surface Area | 55.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 441.194 |
| Heavy Atoms | 33 |
| Complexity | 649.0 |
Chemical Identifiers
| CAS Number | 33567-56-5 |
|---|---|
| SMILES | CCOC(=O)C1=C(C(N(C1C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4)C(=O)OCC |
| InChIKey | NHOFTFPUBOZDPJ-UHFFFAOYSA-N |
Product Overview
Diethyl 1,2,5-triphenyl-2,5-dihydropyrrole-3,4-dicarboxylate (CAS 33567-56-5), with molecular formula C28H27NO4 and molecular weight 441.19 g/mol. IUPAC: diethyl 1,2,5-triphenyl-2,5-dihydropyrrole-3,4-dicarboxylate.
Chemical Property Profile of Diethyl 1,2,5-triphenyl-2,5-dihydropyrrole-3,4-dicarboxylate
Property Insights of Diethyl 1,2,5-triphenyl-2,5-dihydropyrrole-3,4-dicarboxylate
The XLogP value of 5.5 indicates that Diethyl 1,2,5-triphenyl-2,5-dihydropyrrole-3,4-dicarboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.8 Ų, Diethyl 1,2,5-triphenyl-2,5-dihydropyrrole-3,4-dicarboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Diethyl 1,2,5-triphenyl-2,5-dihydropyrrole-3,4-dicarboxylate has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Diethyl 1,2,5-triphenyl-2,5-dihydropyrrole-3,4-dicarboxylate?
The CAS number of Diethyl 1,2,5-triphenyl-2,5-dihydropyrrole-3,4-dicarboxylate is 33567-56-5.
What is the molecular formula of Diethyl 1,2,5-triphenyl-2,5-dihydropyrrole-3,4-dicarboxylate?
The molecular formula of Diethyl 1,2,5-triphenyl-2,5-dihydropyrrole-3,4-dicarboxylate is C28H27NO4.
What is the molecular weight of Diethyl 1,2,5-triphenyl-2,5-dihydropyrrole-3,4-dicarboxylate?
The molecular weight of Diethyl 1,2,5-triphenyl-2,5-dihydropyrrole-3,4-dicarboxylate is 441.19 g/mol.
Where can I buy Diethyl 1,2,5-triphenyl-2,5-dihydropyrrole-3,4-dicarboxylate?
You can request a quote for Diethyl 1,2,5-triphenyl-2,5-dihydropyrrole-3,4-dicarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diethyl 1,2,5-triphenyl-2,5-dihydropyrrole-3,4-dicarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Diethyl 1,2,5-triphenyl-2,5-dihydropyrrole-3,4-dicarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.