diethyl 2,6-dimethyl-4-(2-phenyl-5-thiophen-2-ylpyrazol-3-yl)-1,4-dihydropyridine-3,5-dicarboxylate
TL;DR: diethyl 2,6-dimethyl-4-(2-phenyl-5-thiophen-2-ylpyrazol-3-yl)-1,4-dihydropyridine-3,5-dicarboxylate (CAS 313272-58-1) is a chemical compound with molecular formula C26H27N3O4S and molecular weight 477.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl 2,6-dimethyl-4-(1-phenyl-3-thiophen-2-ylpyrazol-5-yl)-1,4-dihydropyridine-3,5-dicarboxylate
Also Known As: diethyl 2,6-dimethyl-4-(2-phenyl-5-thiophen-2-ylpyrazol-3-yl)-1,4-dihydropyridine-3,5-dicarboxylate, diethyl 2,6-dimethyl-4-(1-phenyl-3-(thiophen-2-yl)-1H-pyrazol-5-yl)-1,4-dihydropyridine-3,5-dicarboxylate, diethyl 2,6-dimethyl-4-[1-phenyl-3-(thiophen-2-yl)-1H-pyrazol-5-yl]-1,4-dihydropyridine-3,5-dicarboxylate
| Molecular Formula | C26H27N3O4S |
|---|---|
| Molecular Weight | 477.17 g/mol |
| LogP | 4.9618 |
| Topological Polar Surface Area | 82.45 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 477.17224 |
| Heavy Atoms | 34 |
| Complexity | 1216.4685 |
Chemical Identifiers
| CAS Number | 313272-58-1 |
|---|---|
| SMILES | CCOC(=O)C1=C(NC(=C(C1C2=CC(=NN2C3=CC=CC=C3)C4=CC=CS4)C(=O)OCC)C)C |
Product Overview
diethyl 2,6-dimethyl-4-(2-phenyl-5-thiophen-2-ylpyrazol-3-yl)-1,4-dihydropyridine-3,5-dicarboxylate (CAS 313272-58-1), with molecular formula C26H27N3O4S and molecular weight 477.17 g/mol. IUPAC: diethyl 2,6-dimethyl-4-(1-phenyl-3-thiophen-2-ylpyrazol-5-yl)-1,4-dihydropyridine-3,5-dicarboxylate.
Chemical Property Profile of diethyl 2,6-dimethyl-4-(2-phenyl-5-thiophen-2-ylpyrazol-3-yl)-1,4-dihydropyridine-3,5-dicarboxylate
Property Insights of diethyl 2,6-dimethyl-4-(2-phenyl-5-thiophen-2-ylpyrazol-3-yl)-1,4-dihydropyridine-3,5-dicarboxylate
The XLogP value of 4.9618 indicates that diethyl 2,6-dimethyl-4-(2-phenyl-5-thiophen-2-ylpyrazol-3-yl)-1,4-dihydropyridine-3,5-dicarboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 82.45 Ų falls within the moderate polarity range, balancing permeability and solubility for diethyl 2,6-dimethyl-4-(2-phenyl-5-thiophen-2-ylpyrazol-3-yl)-1,4-dihydropyridine-3,5-dicarboxylate. Following Lipinski's Rule of Five, diethyl 2,6-dimethyl-4-(2-phenyl-5-thiophen-2-ylpyrazol-3-yl)-1,4-dihydropyridine-3,5-dicarboxylate has 1 hydrogen bond donor(s) and 7 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 2,6-dimethyl-4-(2-phenyl-5-thiophen-2-ylpyrazol-3-yl)-1,4-dihydropyridine-3,5-dicarboxylate?
The CAS number of diethyl 2,6-dimethyl-4-(2-phenyl-5-thiophen-2-ylpyrazol-3-yl)-1,4-dihydropyridine-3,5-dicarboxylate is 313272-58-1.
What is the molecular formula of diethyl 2,6-dimethyl-4-(2-phenyl-5-thiophen-2-ylpyrazol-3-yl)-1,4-dihydropyridine-3,5-dicarboxylate?
The molecular formula of diethyl 2,6-dimethyl-4-(2-phenyl-5-thiophen-2-ylpyrazol-3-yl)-1,4-dihydropyridine-3,5-dicarboxylate is C26H27N3O4S.
What is the molecular weight of diethyl 2,6-dimethyl-4-(2-phenyl-5-thiophen-2-ylpyrazol-3-yl)-1,4-dihydropyridine-3,5-dicarboxylate?
The molecular weight of diethyl 2,6-dimethyl-4-(2-phenyl-5-thiophen-2-ylpyrazol-3-yl)-1,4-dihydropyridine-3,5-dicarboxylate is 477.17 g/mol.
Where can I buy diethyl 2,6-dimethyl-4-(2-phenyl-5-thiophen-2-ylpyrazol-3-yl)-1,4-dihydropyridine-3,5-dicarboxylate?
You can request a quote for diethyl 2,6-dimethyl-4-(2-phenyl-5-thiophen-2-ylpyrazol-3-yl)-1,4-dihydropyridine-3,5-dicarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for diethyl 2,6-dimethyl-4-(2-phenyl-5-thiophen-2-ylpyrazol-3-yl)-1,4-dihydropyridine-3,5-dicarboxylate?
Yes, KEHONG BIO provides custom synthesis services for diethyl 2,6-dimethyl-4-(2-phenyl-5-thiophen-2-ylpyrazol-3-yl)-1,4-dihydropyridine-3,5-dicarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.