Nicotinic acid, 6-(3-diethylamino-2-hydroxypropoxy)-2,4-dimethyl-, ethyl ester
TL;DR: Nicotinic acid, 6-(3-diethylamino-2-hydroxypropoxy)-2,4-dimethyl-, ethyl ester (CAS 54832-24-5) is a chemical compound with molecular formula C17H28N2O4 and molecular weight 324.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 6-[3-(diethylamino)-2-hydroxypropoxy]-2,4-dimethylpyridine-3-carboxylate
Also Known As: 5-22-05-00139 (Beilstein Handbook Reference), nicotinicacid,6-2,4-dimethyl-,ethylester, Nicotinicacid,6- -2,4-dimethyl-,ethylester, ethyl 6-[3-(diethylamino)-2-hydroxypropoxy]-2,4-dimethylpyridine-3-carboxylate, 6-(3-Diethylamino-2-hydroxypropoxy)-2,4-dimethylnicotinic acid ethyl ester
| Molecular Formula | C17H28N2O4 |
|---|---|
| Molecular Weight | 324.20 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 71.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 10 |
| Exact Mass | 324.2049 |
| Heavy Atoms | 23 |
| Complexity | 349.0 |
Chemical Identifiers
| CAS Number | 54832-24-5 |
|---|---|
| SMILES | CCN(CC)CC(COC1=NC(=C(C(=C1)C)C(=O)OCC)C)O |
| InChIKey | WUWPMNXFQYGPBW-UHFFFAOYSA-N |
Product Overview
Nicotinic acid, 6-(3-diethylamino-2-hydroxypropoxy)-2,4-dimethyl-, ethyl ester (CAS 54832-24-5), with molecular formula C17H28N2O4 and molecular weight 324.20 g/mol. IUPAC: ethyl 6-[3-(diethylamino)-2-hydroxypropoxy]-2,4-dimethylpyridine-3-carboxylate.
Chemical Property Profile of Nicotinic acid, 6-(3-diethylamino-2-hydroxypropoxy)-2,4-dimethyl-, ethyl ester
Property Insights of Nicotinic acid, 6-(3-diethylamino-2-hydroxypropoxy)-2,4-dimethyl-, ethyl ester
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Nicotinic acid, 6-(3-diethylamino-2-hydroxypropoxy)-2,4-dimethyl-, ethyl ester. The TPSA of 71.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Nicotinic acid, 6-(3-diethylamino-2-hydroxypropoxy)-2,4-dimethyl-, ethyl ester. Following Lipinski's Rule of Five, Nicotinic acid, 6-(3-diethylamino-2-hydroxypropoxy)-2,4-dimethyl-, ethyl 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 Nicotinic acid, 6-(3-diethylamino-2-hydroxypropoxy)-2,4-dimethyl-, ethyl ester?
The CAS number of Nicotinic acid, 6-(3-diethylamino-2-hydroxypropoxy)-2,4-dimethyl-, ethyl ester is 54832-24-5.
What is the molecular formula of Nicotinic acid, 6-(3-diethylamino-2-hydroxypropoxy)-2,4-dimethyl-, ethyl ester?
The molecular formula of Nicotinic acid, 6-(3-diethylamino-2-hydroxypropoxy)-2,4-dimethyl-, ethyl ester is C17H28N2O4.
What is the molecular weight of Nicotinic acid, 6-(3-diethylamino-2-hydroxypropoxy)-2,4-dimethyl-, ethyl ester?
The molecular weight of Nicotinic acid, 6-(3-diethylamino-2-hydroxypropoxy)-2,4-dimethyl-, ethyl ester is 324.20 g/mol.
Where can I buy Nicotinic acid, 6-(3-diethylamino-2-hydroxypropoxy)-2,4-dimethyl-, ethyl ester?
You can request a quote for Nicotinic acid, 6-(3-diethylamino-2-hydroxypropoxy)-2,4-dimethyl-, ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Nicotinic acid, 6-(3-diethylamino-2-hydroxypropoxy)-2,4-dimethyl-, ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for Nicotinic acid, 6-(3-diethylamino-2-hydroxypropoxy)-2,4-dimethyl-, ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.