Ethyl 3-(4-methoxyphenyl)-4,5-diphenyl-1h-pyrrole-2-carboxylate
TL;DR: Ethyl 3-(4-methoxyphenyl)-4,5-diphenyl-1h-pyrrole-2-carboxylate (CAS 28714-80-9) is a chemical compound with molecular formula C26H23NO3 and molecular weight 397.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-(4-methoxyphenyl)-4,5-diphenyl-1H-pyrrole-2-carboxylate
Also Known As: ethyl 3-(4-methoxyphenyl)-4,5-diphenyl-1h-pyrrole-2-carboxylate, ethyl 3-(4-methoxyphenyl)-4,5-diphenyl-1H-pyrrole-2-carboxyl, 1H-Pyrrole-2-carboxylicacid, 3-(4-methoxyphenyl)-4,5-diphenyl-, ethyl ester
| Molecular Formula | C26H23NO3 |
|---|---|
| Molecular Weight | 397.17 g/mol |
| LogP | 6.1 |
| Topological Polar Surface Area | 51.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 397.1678 |
| Heavy Atoms | 30 |
| Complexity | 532.0 |
Chemical Identifiers
| CAS Number | 28714-80-9 |
|---|---|
| SMILES | CCOC(=O)C1=C(C(=C(N1)C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=C(C=C4)OC |
| InChIKey | CSCHLWPUQYPQCW-UHFFFAOYSA-N |
Product Overview
Ethyl 3-(4-methoxyphenyl)-4,5-diphenyl-1h-pyrrole-2-carboxylate (CAS 28714-80-9), with molecular formula C26H23NO3 and molecular weight 397.17 g/mol. IUPAC: ethyl 3-(4-methoxyphenyl)-4,5-diphenyl-1H-pyrrole-2-carboxylate.
Chemical Property Profile of Ethyl 3-(4-methoxyphenyl)-4,5-diphenyl-1h-pyrrole-2-carboxylate
Property Insights of Ethyl 3-(4-methoxyphenyl)-4,5-diphenyl-1h-pyrrole-2-carboxylate
The XLogP value of 6.1 indicates that Ethyl 3-(4-methoxyphenyl)-4,5-diphenyl-1h-pyrrole-2-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.3 Ų, Ethyl 3-(4-methoxyphenyl)-4,5-diphenyl-1h-pyrrole-2-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 3-(4-methoxyphenyl)-4,5-diphenyl-1h-pyrrole-2-carboxylate has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Ethyl 3-(4-methoxyphenyl)-4,5-diphenyl-1h-pyrrole-2-carboxylate?
The CAS number of Ethyl 3-(4-methoxyphenyl)-4,5-diphenyl-1h-pyrrole-2-carboxylate is 28714-80-9.
What is the molecular formula of Ethyl 3-(4-methoxyphenyl)-4,5-diphenyl-1h-pyrrole-2-carboxylate?
The molecular formula of Ethyl 3-(4-methoxyphenyl)-4,5-diphenyl-1h-pyrrole-2-carboxylate is C26H23NO3.
What is the molecular weight of Ethyl 3-(4-methoxyphenyl)-4,5-diphenyl-1h-pyrrole-2-carboxylate?
The molecular weight of Ethyl 3-(4-methoxyphenyl)-4,5-diphenyl-1h-pyrrole-2-carboxylate is 397.17 g/mol.
Where can I buy Ethyl 3-(4-methoxyphenyl)-4,5-diphenyl-1h-pyrrole-2-carboxylate?
You can request a quote for Ethyl 3-(4-methoxyphenyl)-4,5-diphenyl-1h-pyrrole-2-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 3-(4-methoxyphenyl)-4,5-diphenyl-1h-pyrrole-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 3-(4-methoxyphenyl)-4,5-diphenyl-1h-pyrrole-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.