3-N,5-N-dibenzyl-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxamide
TL;DR: 3-N,5-N-dibenzyl-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxamide (CAS 86683-28-5) is a chemical compound with molecular formula C29H28N4O4 and molecular weight 496.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-N,5-N-dibenzyl-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxamide
Also Known As: 3-N,5-N-dibenzyl-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxamide, 3-N,5-N-dibenzyl-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydrop, N(3),N(5)-DIBENZYL-2,6-DI-ME-4-(3-NITROPHENYL)-1,4-2H-3,5-PYRIDINEDICARBOXAMIDE, N,N'-dibenzyl-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxamide, N~3~,N~5~-Dibenzyl-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxamide
| Molecular Formula | C29H28N4O4 |
|---|---|
| Molecular Weight | 496.21 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 116.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 496.21106 |
| Heavy Atoms | 37 |
| Complexity | 853.0 |
Chemical Identifiers
| CAS Number | 86683-28-5 |
|---|---|
| SMILES | CC1=C(C(C(=C(N1)C)C(=O)NCC2=CC=CC=C2)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)NCC4=CC=CC=C4 |
| InChIKey | YKAAFSQBYXGLLT-UHFFFAOYSA-N |
Product Overview
3-N,5-N-dibenzyl-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxamide (CAS 86683-28-5), with molecular formula C29H28N4O4 and molecular weight 496.21 g/mol. IUPAC: 3-N,5-N-dibenzyl-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxamide.
Chemical Property Profile of 3-N,5-N-dibenzyl-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxamide
Property Insights of 3-N,5-N-dibenzyl-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxamide
The XLogP value of 4.4 indicates that 3-N,5-N-dibenzyl-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 116.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-N,5-N-dibenzyl-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxamide. Following Lipinski's Rule of Five, 3-N,5-N-dibenzyl-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxamide has 3 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 3-N,5-N-dibenzyl-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxamide?
The CAS number of 3-N,5-N-dibenzyl-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxamide is 86683-28-5.
What is the molecular formula of 3-N,5-N-dibenzyl-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxamide?
The molecular formula of 3-N,5-N-dibenzyl-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxamide is C29H28N4O4.
What is the molecular weight of 3-N,5-N-dibenzyl-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxamide?
The molecular weight of 3-N,5-N-dibenzyl-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxamide is 496.21 g/mol.
Where can I buy 3-N,5-N-dibenzyl-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxamide?
You can request a quote for 3-N,5-N-dibenzyl-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-N,5-N-dibenzyl-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxamide?
Yes, KEHONG BIO provides custom synthesis services for 3-N,5-N-dibenzyl-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.