N-Nicotinoyl-gamma-aminobutyric acid ethanolamine salt
TL;DR: N-Nicotinoyl-gamma-aminobutyric acid ethanolamine salt (CAS 113694-82-9) is a chemical compound with molecular formula C12H19N3O4 and molecular weight 269.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-aminoethanol;4-(pyridine-3-carbonylamino)butanoic acid
Also Known As: N-Nicotinoyl-gamma-aminobutyric acid ethanolamine salt, 4-((3-Pyridinylcarbonyl)amino)butanoic acid 2-aminoethanol salt, Butyric acid, 4-nicotinamido-, 2-aminoethanol salt (1:1), 2-aminoethanol; 4-(pyridine-3-carbonylamino)butanoic acid, Butanoic aicd, 4-((3-pyridinylcarbonyl)amino)-, compd. with 2-aminoethanol salt (1:1)
| Molecular Formula | C12H19N3O4 |
|---|---|
| Molecular Weight | 269.14 g/mol |
| LogP | -0.3864 |
| Topological Polar Surface Area | 125.54 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 269.13754 |
| Heavy Atoms | 19 |
| Complexity | 368.49707 |
Chemical Identifiers
| CAS Number | 113694-82-9 |
|---|---|
| SMILES | C1=CC(=CN=C1)C(=O)NCCCC(=O)O.C(CO)N |
Product Overview
N-Nicotinoyl-gamma-aminobutyric acid ethanolamine salt (CAS 113694-82-9), with molecular formula C12H19N3O4 and molecular weight 269.14 g/mol. IUPAC: 2-aminoethanol;4-(pyridine-3-carbonylamino)butanoic acid.
Chemical Property Profile of N-Nicotinoyl-gamma-aminobutyric acid ethanolamine salt
Property Insights of N-Nicotinoyl-gamma-aminobutyric acid ethanolamine salt
The XLogP value of -0.3864 indicates that N-Nicotinoyl-gamma-aminobutyric acid ethanolamine salt is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 125.54 Ų falls within the moderate polarity range, balancing permeability and solubility for N-Nicotinoyl-gamma-aminobutyric acid ethanolamine salt. Following Lipinski's Rule of Five, N-Nicotinoyl-gamma-aminobutyric acid ethanolamine salt has 4 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 N-Nicotinoyl-gamma-aminobutyric acid ethanolamine salt?
The CAS number of N-Nicotinoyl-gamma-aminobutyric acid ethanolamine salt is 113694-82-9.
What is the molecular formula of N-Nicotinoyl-gamma-aminobutyric acid ethanolamine salt?
The molecular formula of N-Nicotinoyl-gamma-aminobutyric acid ethanolamine salt is C12H19N3O4.
What is the molecular weight of N-Nicotinoyl-gamma-aminobutyric acid ethanolamine salt?
The molecular weight of N-Nicotinoyl-gamma-aminobutyric acid ethanolamine salt is 269.14 g/mol.
Where can I buy N-Nicotinoyl-gamma-aminobutyric acid ethanolamine salt?
You can request a quote for N-Nicotinoyl-gamma-aminobutyric acid ethanolamine salt directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Nicotinoyl-gamma-aminobutyric acid ethanolamine salt?
Yes, KEHONG BIO provides custom synthesis services for N-Nicotinoyl-gamma-aminobutyric acid ethanolamine salt and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.