diethyl 5,5'-methanediylbis(3-ethyl-4-methyl-1h-pyrrole-2-carboxylate)
TL;DR: diethyl 5,5'-methanediylbis(3-ethyl-4-methyl-1h-pyrrole-2-carboxylate) (CAS 7689-60-3) is a chemical compound with molecular formula C21H30N2O4 and molecular weight 374.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 5-[(5-ethoxycarbonyl-4-ethyl-3-methyl-1H-pyrrol-2-yl)methyl]-3-ethyl-4-methyl-1H-pyrrole-2-carboxylate
Also Known As: diethyl 5,5'-methanediylbis(3-ethyl-4-methyl-1h-pyrrole-2-carboxylate), Diethyl 5,5'-methylenebis(3-ethyl-4-methyl-1H-pyrrole-2-carboxylate), ethyl 5-[(5-ethoxycarbonyl-4-ethyl-3-methyl-1H-pyrrol-2-yl)methyl]-3-ethyl-4-methyl-1H-pyrrole-2-carboxylate, 1H-Pyrrole-2-carboxylicacid, 5,5'-methylenebis[3-ethyl-4-methyl-, diethyl ester (9CI), diethyl 4,4'-diethyl-3,3'-dimethyl-2,2'-dipyrrylmethane-5,5'-dicarboxylate
| Molecular Formula | C21H30N2O4 |
|---|---|
| Molecular Weight | 374.22 g/mol |
| LogP | 4.9 |
| Topological Polar Surface Area | 84.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 10 |
| Exact Mass | 374.22055 |
| Heavy Atoms | 27 |
| Complexity | 468.0 |
Chemical Identifiers
| CAS Number | 7689-60-3 |
|---|---|
| SMILES | CCC1=C(NC(=C1C)CC2=C(C(=C(N2)C(=O)OCC)CC)C)C(=O)OCC |
| InChIKey | JCTMBGKZYBQGPL-UHFFFAOYSA-N |
Product Overview
diethyl 5,5'-methanediylbis(3-ethyl-4-methyl-1h-pyrrole-2-carboxylate) (CAS 7689-60-3), with molecular formula C21H30N2O4 and molecular weight 374.22 g/mol. IUPAC: ethyl 5-[(5-ethoxycarbonyl-4-ethyl-3-methyl-1H-pyrrol-2-yl)methyl]-3-ethyl-4-methyl-1H-pyrrole-2-carboxylate.
Chemical Property Profile of diethyl 5,5'-methanediylbis(3-ethyl-4-methyl-1h-pyrrole-2-carboxylate)
Property Insights of diethyl 5,5'-methanediylbis(3-ethyl-4-methyl-1h-pyrrole-2-carboxylate)
The XLogP value of 4.9 indicates that diethyl 5,5'-methanediylbis(3-ethyl-4-methyl-1h-pyrrole-2-carboxylate) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.2 Ų falls within the moderate polarity range, balancing permeability and solubility for diethyl 5,5'-methanediylbis(3-ethyl-4-methyl-1h-pyrrole-2-carboxylate). Following Lipinski's Rule of Five, diethyl 5,5'-methanediylbis(3-ethyl-4-methyl-1h-pyrrole-2-carboxylate) has 2 hydrogen bond donor(s) and 4 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 diethyl 5,5'-methanediylbis(3-ethyl-4-methyl-1h-pyrrole-2-carboxylate)?
The CAS number of diethyl 5,5'-methanediylbis(3-ethyl-4-methyl-1h-pyrrole-2-carboxylate) is 7689-60-3.
What is the molecular formula of diethyl 5,5'-methanediylbis(3-ethyl-4-methyl-1h-pyrrole-2-carboxylate)?
The molecular formula of diethyl 5,5'-methanediylbis(3-ethyl-4-methyl-1h-pyrrole-2-carboxylate) is C21H30N2O4.
What is the molecular weight of diethyl 5,5'-methanediylbis(3-ethyl-4-methyl-1h-pyrrole-2-carboxylate)?
The molecular weight of diethyl 5,5'-methanediylbis(3-ethyl-4-methyl-1h-pyrrole-2-carboxylate) is 374.22 g/mol.
Where can I buy diethyl 5,5'-methanediylbis(3-ethyl-4-methyl-1h-pyrrole-2-carboxylate)?
You can request a quote for diethyl 5,5'-methanediylbis(3-ethyl-4-methyl-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 diethyl 5,5'-methanediylbis(3-ethyl-4-methyl-1h-pyrrole-2-carboxylate)?
Yes, KEHONG BIO provides custom synthesis services for diethyl 5,5'-methanediylbis(3-ethyl-4-methyl-1h-pyrrole-2-carboxylate) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.