5-acetyl-1-methyl-2,4(1H,3H)-pyrimidinedione
TL;DR: 5-acetyl-1-methyl-2,4(1H,3H)-pyrimidinedione (CAS 36980-85-5) is a chemical compound with molecular formula C7H8N2O3 and molecular weight 168.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-acetyl-1-methylpyrimidine-2,4-dione
Also Known As: 5-acetyl-1-methyl-2,4(1H,3H)-pyrimidinedione, 5-acetyl-1-methylpyrimidine-2,4-dione, 5-acetyl-1-methyl-1,2,3,4-tetrahydropyrimidine-2,4-dione, 5-acetyl-1-methyl-pyrimidine-2,4-dione, 5-acetyl-1-methyl-3H-pyrimidine-2,4-dione
| Molecular Formula | C7H8N2O3 |
|---|---|
| Molecular Weight | 168.05 g/mol |
| LogP | -0.7238 |
| Topological Polar Surface Area | 71.93 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 168.0535 |
| Heavy Atoms | 12 |
| Complexity | 427.013 |
Chemical Identifiers
| CAS Number | 36980-85-5 |
|---|---|
| SMILES | CC(=O)C1=CN(C(=O)NC1=O)C |
Product Overview
5-acetyl-1-methyl-2,4(1H,3H)-pyrimidinedione (CAS 36980-85-5), with molecular formula C7H8N2O3 and molecular weight 168.05 g/mol. IUPAC: 5-acetyl-1-methylpyrimidine-2,4-dione.
Chemical Property Profile of 5-acetyl-1-methyl-2,4(1H,3H)-pyrimidinedione
Property Insights of 5-acetyl-1-methyl-2,4(1H,3H)-pyrimidinedione
The XLogP value of -0.7238 indicates that 5-acetyl-1-methyl-2,4(1H,3H)-pyrimidinedione is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 71.93 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-acetyl-1-methyl-2,4(1H,3H)-pyrimidinedione. Following Lipinski's Rule of Five, 5-acetyl-1-methyl-2,4(1H,3H)-pyrimidinedione has 1 hydrogen bond donor(s) and 3 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 5-acetyl-1-methyl-2,4(1H,3H)-pyrimidinedione?
The CAS number of 5-acetyl-1-methyl-2,4(1H,3H)-pyrimidinedione is 36980-85-5.
What is the molecular formula of 5-acetyl-1-methyl-2,4(1H,3H)-pyrimidinedione?
The molecular formula of 5-acetyl-1-methyl-2,4(1H,3H)-pyrimidinedione is C7H8N2O3.
What is the molecular weight of 5-acetyl-1-methyl-2,4(1H,3H)-pyrimidinedione?
The molecular weight of 5-acetyl-1-methyl-2,4(1H,3H)-pyrimidinedione is 168.05 g/mol.
Where can I buy 5-acetyl-1-methyl-2,4(1H,3H)-pyrimidinedione?
You can request a quote for 5-acetyl-1-methyl-2,4(1H,3H)-pyrimidinedione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-acetyl-1-methyl-2,4(1H,3H)-pyrimidinedione?
Yes, KEHONG BIO provides custom synthesis services for 5-acetyl-1-methyl-2,4(1H,3H)-pyrimidinedione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.