3-Hydroxy-polydeoxycholic acid
TL;DR: 3-Hydroxy-polydeoxycholic acid (CAS 115348-42-0) is a chemical compound with molecular formula C12H10CuN4O6 and molecular weight 368.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
copper;N-(pyridine-2-carbonyl)pyridine-2-carboximidate;nitrate;hydrate
Also Known As: 3-Hydroxy-polydeoxycholic acid, Aqua(N-(2-pyridinylcarbonyl)-2-pyridinecarboxamidato-N1,N2,N2')copper(1+) nitrate, Copper(1+), aqua(N-(2-pyridinylcarbonyl)-2-pyridinecarboxamidato-N1,N2,N2')-, nitrate, copper N-(pyridine-2-carbonyl)pyridine-2-carboximidate nitrate hydrate, Copper(2+) nitrate N-(pyridine-2-carbonyl)pyridine-2-carboximidate--water (1/1/1/1)
| Molecular Formula | C12H10CuN4O6 |
|---|---|
| Molecular Weight | 368.99 g/mol |
| LogP | -0.6424 |
| Topological Polar Surface Area | 142.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 2 |
| Exact Mass | 368.98962 |
| Heavy Atoms | 23 |
| Complexity | 295.0 |
Chemical Identifiers
| CAS Number | 115348-42-0 |
|---|---|
| SMILES | C1=CC=NC(=C1)C(=NC(=O)C2=CC=CC=N2)[O-].[N+](=O)([O-])[O-].O.[Cu+2] |
| InChIKey | KHPDDHMLZLNUCZ-UHFFFAOYSA-M |
Product Overview
3-Hydroxy-polydeoxycholic acid (CAS 115348-42-0), with molecular formula C12H10CuN4O6 and molecular weight 368.99 g/mol. IUPAC: copper;N-(pyridine-2-carbonyl)pyridine-2-carboximidate;nitrate;hydrate.
Chemical Property Profile of 3-Hydroxy-polydeoxycholic acid
Property Insights of 3-Hydroxy-polydeoxycholic acid
The XLogP value of -0.6424 indicates that 3-Hydroxy-polydeoxycholic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 142.0 Ų indicates high polarity, suggesting 3-Hydroxy-polydeoxycholic acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 3-Hydroxy-polydeoxycholic acid has 1 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-Hydroxy-polydeoxycholic acid?
The CAS number of 3-Hydroxy-polydeoxycholic acid is 115348-42-0.
What is the molecular formula of 3-Hydroxy-polydeoxycholic acid?
The molecular formula of 3-Hydroxy-polydeoxycholic acid is C12H10CuN4O6.
What is the molecular weight of 3-Hydroxy-polydeoxycholic acid?
The molecular weight of 3-Hydroxy-polydeoxycholic acid is 368.99 g/mol.
Where can I buy 3-Hydroxy-polydeoxycholic acid?
You can request a quote for 3-Hydroxy-polydeoxycholic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Hydroxy-polydeoxycholic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-Hydroxy-polydeoxycholic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.