Hantzsch 1,4-dihydropyridine ester
TL;DR: Hantzsch 1,4-dihydropyridine ester (CAS 10354-31-1) is a chemical compound with molecular formula C20H25NO6 and molecular weight 375.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl 4-(4-hydroxy-3-methoxyphenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate
Also Known As: Hantzsch 1,4-dihydropyridine ester, BAS 00873825, J1.427.385I, diethyl 4-(4-hydroxy-3-methoxyphenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate, Diethyl 4-(4-hydroxy-3-methoxyphenyl)-2,6-dimethyl-1,4-dihydro-3,5-pyridinedicarboxylate
| Molecular Formula | C20H25NO6 |
|---|---|
| Molecular Weight | 375.17 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 94.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 375.16818 |
| Heavy Atoms | 27 |
| Complexity | 598.0 |
Chemical Identifiers
| CAS Number | 10354-31-1 |
|---|---|
| SMILES | CCOC(=O)C1=C(NC(=C(C1C2=CC(=C(C=C2)O)OC)C(=O)OCC)C)C |
| InChIKey | SDMZMDLTNSKXGE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Hantzsch 1,4-dihydropyridine ester (CAS 10354-31-1), with molecular formula C20H25NO6 and molecular weight 375.17 g/mol. IUPAC: diethyl 4-(4-hydroxy-3-methoxyphenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate.
Chemical Property Profile of Hantzsch 1,4-dihydropyridine ester
Property Insights of Hantzsch 1,4-dihydropyridine ester
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Hantzsch 1,4-dihydropyridine ester. The TPSA of 94.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Hantzsch 1,4-dihydropyridine ester. Following Lipinski's Rule of Five, Hantzsch 1,4-dihydropyridine ester has 2 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 Hantzsch 1,4-dihydropyridine ester?
The CAS number of Hantzsch 1,4-dihydropyridine ester is 10354-31-1.
What is the molecular formula of Hantzsch 1,4-dihydropyridine ester?
The molecular formula of Hantzsch 1,4-dihydropyridine ester is C20H25NO6.
What is the molecular weight of Hantzsch 1,4-dihydropyridine ester?
The molecular weight of Hantzsch 1,4-dihydropyridine ester is 375.17 g/mol.
Where can I buy Hantzsch 1,4-dihydropyridine ester?
You can request a quote for Hantzsch 1,4-dihydropyridine ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Hantzsch 1,4-dihydropyridine ester?
Yes, KEHONG BIO provides custom synthesis services for Hantzsch 1,4-dihydropyridine ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.