1,3-Pyrimidinedipropionic acid, hexahydro-5-(p-methoxybenzylidene)-2,4,6-trioxo-, dipotassium salt
TL;DR: 1,3-Pyrimidinedipropionic acid, hexahydro-5-(p-methoxybenzylidene)-2,4,6-trioxo-, dipotassium salt (CAS 78472-88-5) is a chemical compound with molecular formula C18H16K2N2O8 and molecular weight 466.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dipotassium;3-[3-(2-carboxylatoethyl)-5-[(4-methoxyphenyl)methylidene]-2,4,6-trioxo-1,3-diazinan-1-yl]propanoate
Also Known As: 1,3-Pyrimidinedipropionic acid, hexahydro-5-(p-methoxybenzylidene)-2,4,6-trioxo-, dipotassium salt, Barbituric acid, 1,3-bis(2-carboxyethyl)-5-(p-methoxybenzylidine)-, dipotassium salt, Dipotassium 3,3'-{5-[(4-methoxyphenyl)methylidene]-2,4,6-trioxo-1,3-diazinane-1,3-diyl}dipropanoate, dipotassium 3-[5-[(4-methoxyphenyl)methylidene]-3-(3-oxido-3-oxopropyl)-2,4,6-trioxo-1,3-diazinan-1-yl]propanoate, Hexahydro-5-(4-methoxybenzylidene)-2,4,6-trioxo-1,3-pyrimidinedipropionic acid dipotassium salt
| Molecular Formula | C18H16K2N2O8 |
|---|---|
| Molecular Weight | 466.02 g/mol |
| LogP | -7.8426 |
| Topological Polar Surface Area | 147.18 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 466.01807 |
| Heavy Atoms | 30 |
| Complexity | 812.24725 |
Chemical Identifiers
| CAS Number | 78472-88-5 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C=C2C(=O)N(C(=O)N(C2=O)CCC(=O)[O-])CCC(=O)[O-].[K+].[K+] |
Product Overview
1,3-Pyrimidinedipropionic acid, hexahydro-5-(p-methoxybenzylidene)-2,4,6-trioxo-, dipotassium salt (CAS 78472-88-5), with molecular formula C18H16K2N2O8 and molecular weight 466.02 g/mol. IUPAC: dipotassium;3-[3-(2-carboxylatoethyl)-5-[(4-methoxyphenyl)methylidene]-2,4,6-trioxo-1,3-diazinan-1-yl]propanoate.
Chemical Property Profile of 1,3-Pyrimidinedipropionic acid, hexahydro-5-(p-methoxybenzylidene)-2,4,6-trioxo-, dipotassium salt
Property Insights of 1,3-Pyrimidinedipropionic acid, hexahydro-5-(p-methoxybenzylidene)-2,4,6-trioxo-, dipotassium salt
The XLogP value of -7.8426 indicates that 1,3-Pyrimidinedipropionic acid, hexahydro-5-(p-methoxybenzylidene)-2,4,6-trioxo-, dipotassium salt is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 147.18 Ų indicates high polarity, suggesting 1,3-Pyrimidinedipropionic acid, hexahydro-5-(p-methoxybenzylidene)-2,4,6-trioxo-, dipotassium salt may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1,3-Pyrimidinedipropionic acid, hexahydro-5-(p-methoxybenzylidene)-2,4,6-trioxo-, dipotassium salt has 0 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 1,3-Pyrimidinedipropionic acid, hexahydro-5-(p-methoxybenzylidene)-2,4,6-trioxo-, dipotassium salt?
The CAS number of 1,3-Pyrimidinedipropionic acid, hexahydro-5-(p-methoxybenzylidene)-2,4,6-trioxo-, dipotassium salt is 78472-88-5.
What is the molecular formula of 1,3-Pyrimidinedipropionic acid, hexahydro-5-(p-methoxybenzylidene)-2,4,6-trioxo-, dipotassium salt?
The molecular formula of 1,3-Pyrimidinedipropionic acid, hexahydro-5-(p-methoxybenzylidene)-2,4,6-trioxo-, dipotassium salt is C18H16K2N2O8.
What is the molecular weight of 1,3-Pyrimidinedipropionic acid, hexahydro-5-(p-methoxybenzylidene)-2,4,6-trioxo-, dipotassium salt?
The molecular weight of 1,3-Pyrimidinedipropionic acid, hexahydro-5-(p-methoxybenzylidene)-2,4,6-trioxo-, dipotassium salt is 466.02 g/mol.
Where can I buy 1,3-Pyrimidinedipropionic acid, hexahydro-5-(p-methoxybenzylidene)-2,4,6-trioxo-, dipotassium salt?
You can request a quote for 1,3-Pyrimidinedipropionic acid, hexahydro-5-(p-methoxybenzylidene)-2,4,6-trioxo-, dipotassium salt directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Pyrimidinedipropionic acid, hexahydro-5-(p-methoxybenzylidene)-2,4,6-trioxo-, dipotassium salt?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Pyrimidinedipropionic acid, hexahydro-5-(p-methoxybenzylidene)-2,4,6-trioxo-, dipotassium salt and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.