Nickel gamma-aminobutyratopantothenate
TL;DR: Nickel gamma-aminobutyratopantothenate (CAS 85625-89-4) is a chemical compound with molecular formula C13H24N2NiO7 and molecular weight 378.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-aminobutanoate;3-[(2,4-dihydroxy-3,3-dimethylbutanoyl)amino]propanoate;nickel(2+)
Also Known As: Nickel gamma-aminobutyratopantothenate, Nickel, (4-aminobutanoato-N,O)(N-(2,4-dihydroxy-3,3-dimethyl-1-oxobutyl)-beta-alaninato)-, 4-aminobutanoate; 3-[(2,4-dihydroxy-3,3-dimethylbutanoyl)amino]propanoate; nickel(2+)
| Molecular Formula | C13H24N2NiO7 |
|---|---|
| Molecular Weight | 378.09 g/mol |
| LogP | -3.9053 |
| Topological Polar Surface Area | 175.84 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 9 |
| Exact Mass | 378.0937 |
| Heavy Atoms | 23 |
| Complexity | 364.2322 |
Chemical Identifiers
| CAS Number | 85625-89-4 |
|---|---|
| SMILES | CC(C)(CO)C(C(=O)NCCC(=O)[O-])O.C(CC(=O)[O-])CN.[Ni+2] |
Product Overview
Nickel gamma-aminobutyratopantothenate (CAS 85625-89-4), with molecular formula C13H24N2NiO7 and molecular weight 378.09 g/mol. IUPAC: 4-aminobutanoate;3-[(2,4-dihydroxy-3,3-dimethylbutanoyl)amino]propanoate;nickel(2+).
Chemical Property Profile of Nickel gamma-aminobutyratopantothenate
Property Insights of Nickel gamma-aminobutyratopantothenate
The XLogP value of -3.9053 indicates that Nickel gamma-aminobutyratopantothenate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 175.84 Ų indicates high polarity, suggesting Nickel gamma-aminobutyratopantothenate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Nickel gamma-aminobutyratopantothenate has 4 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 Nickel gamma-aminobutyratopantothenate?
The CAS number of Nickel gamma-aminobutyratopantothenate is 85625-89-4.
What is the molecular formula of Nickel gamma-aminobutyratopantothenate?
The molecular formula of Nickel gamma-aminobutyratopantothenate is C13H24N2NiO7.
What is the molecular weight of Nickel gamma-aminobutyratopantothenate?
The molecular weight of Nickel gamma-aminobutyratopantothenate is 378.09 g/mol.
Where can I buy Nickel gamma-aminobutyratopantothenate?
You can request a quote for Nickel gamma-aminobutyratopantothenate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Nickel gamma-aminobutyratopantothenate?
Yes, KEHONG BIO provides custom synthesis services for Nickel gamma-aminobutyratopantothenate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.