4,6(1H,5H)-Pyrimidinedione
TL;DR: 4,6(1H,5H)-Pyrimidinedione (CAS 25286-58-2) is a chemical compound with molecular formula C4H4N2O2 and molecular weight 112.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1H-pyrimidine-4,6-dione
Also Known As: Pyrimidine-4,6(1H,5H)-dione, dioxopyrimidine, 1H-pyrimidine-4,6-dione, 4,6(1H,5H)-PYRIMIDINEDIONE, 4,6-Dioxo-pyrimidin
| Molecular Formula | C4H4N2O2 |
|---|---|
| Molecular Weight | 112.03 g/mol |
| LogP | -0.9388 |
| Topological Polar Surface Area | 58.53 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 112.027275 |
| Heavy Atoms | 8 |
| Complexity | 161.42125 |
Chemical Identifiers
| CAS Number | 25286-58-2 |
|---|---|
| SMILES | C1C(=O)NC=NC1=O |
Product Overview
4,6(1H,5H)-Pyrimidinedione (CAS 25286-58-2), with molecular formula C4H4N2O2 and molecular weight 112.03 g/mol. IUPAC: 1H-pyrimidine-4,6-dione.
Chemical Property Profile of 4,6(1H,5H)-Pyrimidinedione
Property Insights of 4,6(1H,5H)-Pyrimidinedione
The XLogP value of -0.9388 indicates that 4,6(1H,5H)-Pyrimidinedione is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 58.53 Ų, 4,6(1H,5H)-Pyrimidinedione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,6(1H,5H)-Pyrimidinedione has 1 hydrogen bond donor(s) and 2 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 4,6(1H,5H)-Pyrimidinedione?
The CAS number of 4,6(1H,5H)-Pyrimidinedione is 25286-58-2.
What is the molecular formula of 4,6(1H,5H)-Pyrimidinedione?
The molecular formula of 4,6(1H,5H)-Pyrimidinedione is C4H4N2O2.
What is the molecular weight of 4,6(1H,5H)-Pyrimidinedione?
The molecular weight of 4,6(1H,5H)-Pyrimidinedione is 112.03 g/mol.
Where can I buy 4,6(1H,5H)-Pyrimidinedione?
You can request a quote for 4,6(1H,5H)-Pyrimidinedione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,6(1H,5H)-Pyrimidinedione?
Yes, KEHONG BIO provides custom synthesis services for 4,6(1H,5H)-Pyrimidinedione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.