Di(tert-butyl) 4-isopropyl-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate
TL;DR: Di(tert-butyl) 4-isopropyl-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate (CAS 367500-59-2) is a chemical compound with molecular formula C20H33NO4 and molecular weight 351.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ditert-butyl 2,6-dimethyl-4-propan-2-yl-1,4-dihydropyridine-3,5-dicarboxylate
Also Known As: AJ-077/14798001, Di-tert-butyl 4-isopropyl-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate, di(tert-butyl) 4-isopropyl-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate, ditert-butyl 2,6-dimethyl-4-propan-2-yl-1,4-dihydropyridine-3,5-dicarboxylate, tert-butyl 5-[(tert-butyl)oxycarbonyl]-2,6-dimethyl-4-(methylethyl)-1,4-dihydr opyridine-3-carboxylate
| Molecular Formula | C20H33NO4 |
|---|---|
| Molecular Weight | 351.24 g/mol |
| LogP | 4.0932 |
| Topological Polar Surface Area | 64.63 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 351.24097 |
| Heavy Atoms | 25 |
| Complexity | 562.5879 |
Chemical Identifiers
| CAS Number | 367500-59-2 |
|---|---|
| SMILES | CC1=C(C(C(=C(N1)C)C(=O)OC(C)(C)C)C(C)C)C(=O)OC(C)(C)C |
Product Overview
Di(tert-butyl) 4-isopropyl-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate (CAS 367500-59-2), with molecular formula C20H33NO4 and molecular weight 351.24 g/mol. IUPAC: ditert-butyl 2,6-dimethyl-4-propan-2-yl-1,4-dihydropyridine-3,5-dicarboxylate.
Chemical Property Profile of Di(tert-butyl) 4-isopropyl-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate
Property Insights of Di(tert-butyl) 4-isopropyl-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate
The XLogP value of 4.0932 indicates that Di(tert-butyl) 4-isopropyl-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.63 Ų falls within the moderate polarity range, balancing permeability and solubility for Di(tert-butyl) 4-isopropyl-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate. Following Lipinski's Rule of Five, Di(tert-butyl) 4-isopropyl-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate has 1 hydrogen bond donor(s) and 5 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 Di(tert-butyl) 4-isopropyl-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate?
The CAS number of Di(tert-butyl) 4-isopropyl-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate is 367500-59-2.
What is the molecular formula of Di(tert-butyl) 4-isopropyl-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate?
The molecular formula of Di(tert-butyl) 4-isopropyl-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate is C20H33NO4.
What is the molecular weight of Di(tert-butyl) 4-isopropyl-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate?
The molecular weight of Di(tert-butyl) 4-isopropyl-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate is 351.24 g/mol.
Where can I buy Di(tert-butyl) 4-isopropyl-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate?
You can request a quote for Di(tert-butyl) 4-isopropyl-2,6-dimethyl-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 Di(tert-butyl) 4-isopropyl-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Di(tert-butyl) 4-isopropyl-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.