4-(3-Benzyloxy-phenyl)-1,4-dihydro-pyridine-3,5-dicarboxylic acid dimethyl ester
TL;DR: 4-(3-Benzyloxy-phenyl)-1,4-dihydro-pyridine-3,5-dicarboxylic acid dimethyl ester (CAS 347352-63-0) is a chemical compound with molecular formula C22H21NO5 and molecular weight 379.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl 4-(3-phenylmethoxyphenyl)-1,4-dihydropyridine-3,5-dicarboxylate
Also Known As: BIM-0022059.P001, A2379/0100646, dimethyl 4-(3-(benzyloxy)phenyl)-1,4-dihydropyridine-3,5-dicarboxylate, dimethyl 4-(3-phenylmethoxyphenyl)-1,4-dihydropyridine-3,5-dicarboxylate, Dimethyl 4-[3-(benzyloxy)phenyl]-1,4-dihydro-3,5-pyridinedicarboxylate #
| Molecular Formula | C22H21NO5 |
|---|---|
| Molecular Weight | 379.14 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 73.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 379.14197 |
| Heavy Atoms | 28 |
| Complexity | 588.0 |
Chemical Identifiers
| CAS Number | 347352-63-0 |
|---|---|
| SMILES | COC(=O)C1=CNC=C(C1C2=CC(=CC=C2)OCC3=CC=CC=C3)C(=O)OC |
| InChIKey | WVBBZVHUYOBFNU-UHFFFAOYSA-N |
Product Overview
4-(3-Benzyloxy-phenyl)-1,4-dihydro-pyridine-3,5-dicarboxylic acid dimethyl ester (CAS 347352-63-0), with molecular formula C22H21NO5 and molecular weight 379.14 g/mol. IUPAC: dimethyl 4-(3-phenylmethoxyphenyl)-1,4-dihydropyridine-3,5-dicarboxylate.
Chemical Property Profile of 4-(3-Benzyloxy-phenyl)-1,4-dihydro-pyridine-3,5-dicarboxylic acid dimethyl ester
Property Insights of 4-(3-Benzyloxy-phenyl)-1,4-dihydro-pyridine-3,5-dicarboxylic acid dimethyl ester
The XLogP value of 3.3 indicates that 4-(3-Benzyloxy-phenyl)-1,4-dihydro-pyridine-3,5-dicarboxylic acid dimethyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(3-Benzyloxy-phenyl)-1,4-dihydro-pyridine-3,5-dicarboxylic acid dimethyl ester. Following Lipinski's Rule of Five, 4-(3-Benzyloxy-phenyl)-1,4-dihydro-pyridine-3,5-dicarboxylic acid dimethyl ester has 1 hydrogen bond donor(s) and 6 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 4-(3-Benzyloxy-phenyl)-1,4-dihydro-pyridine-3,5-dicarboxylic acid dimethyl ester?
The CAS number of 4-(3-Benzyloxy-phenyl)-1,4-dihydro-pyridine-3,5-dicarboxylic acid dimethyl ester is 347352-63-0.
What is the molecular formula of 4-(3-Benzyloxy-phenyl)-1,4-dihydro-pyridine-3,5-dicarboxylic acid dimethyl ester?
The molecular formula of 4-(3-Benzyloxy-phenyl)-1,4-dihydro-pyridine-3,5-dicarboxylic acid dimethyl ester is C22H21NO5.
What is the molecular weight of 4-(3-Benzyloxy-phenyl)-1,4-dihydro-pyridine-3,5-dicarboxylic acid dimethyl ester?
The molecular weight of 4-(3-Benzyloxy-phenyl)-1,4-dihydro-pyridine-3,5-dicarboxylic acid dimethyl ester is 379.14 g/mol.
Where can I buy 4-(3-Benzyloxy-phenyl)-1,4-dihydro-pyridine-3,5-dicarboxylic acid dimethyl ester?
You can request a quote for 4-(3-Benzyloxy-phenyl)-1,4-dihydro-pyridine-3,5-dicarboxylic acid dimethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(3-Benzyloxy-phenyl)-1,4-dihydro-pyridine-3,5-dicarboxylic acid dimethyl ester?
Yes, KEHONG BIO provides custom synthesis services for 4-(3-Benzyloxy-phenyl)-1,4-dihydro-pyridine-3,5-dicarboxylic acid dimethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.