3-Pyridinecarboxylic acid, 1,4-dihydro-2,6-dimethyl-5-(((2-ethoxyethoxy)amino)carbonyl)-4-(3-nitrophenyl)-, methyl ester
TL;DR: 3-Pyridinecarboxylic acid, 1,4-dihydro-2,6-dimethyl-5-(((2-ethoxyethoxy)amino)carbonyl)-4-(3-nitrophenyl)-, methyl ester (CAS 133147-10-1) is a chemical compound with molecular formula C20H25N3O7 and molecular weight 419.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 5-(2-ethoxyethoxycarbamoyl)-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carboxylate
Also Known As: 3-Pyridinecarboxylic acid, 1,4-dihydro-2,6-dimethyl-5-(((2-ethoxyethoxy)amino)carbonyl)-4-(3-nitrophenyl)-, methyl ester, N-(2-Ethoxyethoxy)-5-(methoxycarbonyl)-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carboximidic acid, 2,6-Dimethyl-4-(3-nitrophenyl)-5-[[(2-ethoxyethoxy)amino]carbonyl]-1,4-dihydropyridine-3-carboxylic acid methyl ester, methyl 5-(2-ethoxyethoxycarbamoyl)-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carboxylate, methyl 5-[(2-ethoxyethoxy)carbamoyl]-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carboxylate
| Molecular Formula | C20H25N3O7 |
|---|---|
| Molecular Weight | 419.17 g/mol |
| LogP | 2.0869 |
| Topological Polar Surface Area | 129.03 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 9 |
| Exact Mass | 419.16925 |
| Heavy Atoms | 30 |
| Complexity | 892.14124 |
Chemical Identifiers
| CAS Number | 133147-10-1 |
|---|---|
| SMILES | CCOCCONC(=O)C1=C(NC(=C(C1C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OC)C)C |
Product Overview
3-Pyridinecarboxylic acid, 1,4-dihydro-2,6-dimethyl-5-(((2-ethoxyethoxy)amino)carbonyl)-4-(3-nitrophenyl)-, methyl ester (CAS 133147-10-1), with molecular formula C20H25N3O7 and molecular weight 419.17 g/mol. IUPAC: methyl 5-(2-ethoxyethoxycarbamoyl)-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carboxylate.
Chemical Property Profile of 3-Pyridinecarboxylic acid, 1,4-dihydro-2,6-dimethyl-5-(((2-ethoxyethoxy)amino)carbonyl)-4-(3-nitrophenyl)-, methyl ester
Property Insights of 3-Pyridinecarboxylic acid, 1,4-dihydro-2,6-dimethyl-5-(((2-ethoxyethoxy)amino)carbonyl)-4-(3-nitrophenyl)-, methyl ester
The XLogP value of 2.0869 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Pyridinecarboxylic acid, 1,4-dihydro-2,6-dimethyl-5-(((2-ethoxyethoxy)amino)carbonyl)-4-(3-nitrophenyl)-, methyl ester. The TPSA of 129.03 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Pyridinecarboxylic acid, 1,4-dihydro-2,6-dimethyl-5-(((2-ethoxyethoxy)amino)carbonyl)-4-(3-nitrophenyl)-, methyl ester. Following Lipinski's Rule of Five, 3-Pyridinecarboxylic acid, 1,4-dihydro-2,6-dimethyl-5-(((2-ethoxyethoxy)amino)carbonyl)-4-(3-nitrophenyl)-, methyl ester has 2 hydrogen bond donor(s) and 8 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-Pyridinecarboxylic acid, 1,4-dihydro-2,6-dimethyl-5-(((2-ethoxyethoxy)amino)carbonyl)-4-(3-nitrophenyl)-, methyl ester?
The CAS number of 3-Pyridinecarboxylic acid, 1,4-dihydro-2,6-dimethyl-5-(((2-ethoxyethoxy)amino)carbonyl)-4-(3-nitrophenyl)-, methyl ester is 133147-10-1.
What is the molecular formula of 3-Pyridinecarboxylic acid, 1,4-dihydro-2,6-dimethyl-5-(((2-ethoxyethoxy)amino)carbonyl)-4-(3-nitrophenyl)-, methyl ester?
The molecular formula of 3-Pyridinecarboxylic acid, 1,4-dihydro-2,6-dimethyl-5-(((2-ethoxyethoxy)amino)carbonyl)-4-(3-nitrophenyl)-, methyl ester is C20H25N3O7.
What is the molecular weight of 3-Pyridinecarboxylic acid, 1,4-dihydro-2,6-dimethyl-5-(((2-ethoxyethoxy)amino)carbonyl)-4-(3-nitrophenyl)-, methyl ester?
The molecular weight of 3-Pyridinecarboxylic acid, 1,4-dihydro-2,6-dimethyl-5-(((2-ethoxyethoxy)amino)carbonyl)-4-(3-nitrophenyl)-, methyl ester is 419.17 g/mol.
Where can I buy 3-Pyridinecarboxylic acid, 1,4-dihydro-2,6-dimethyl-5-(((2-ethoxyethoxy)amino)carbonyl)-4-(3-nitrophenyl)-, methyl ester?
You can request a quote for 3-Pyridinecarboxylic acid, 1,4-dihydro-2,6-dimethyl-5-(((2-ethoxyethoxy)amino)carbonyl)-4-(3-nitrophenyl)-, methyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Pyridinecarboxylic acid, 1,4-dihydro-2,6-dimethyl-5-(((2-ethoxyethoxy)amino)carbonyl)-4-(3-nitrophenyl)-, methyl ester?
Yes, KEHONG BIO provides custom synthesis services for 3-Pyridinecarboxylic acid, 1,4-dihydro-2,6-dimethyl-5-(((2-ethoxyethoxy)amino)carbonyl)-4-(3-nitrophenyl)-, methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.