1,3,5-Trimethyl-2,4,6(1H,3H,5H)-pyrimidinetrione
TL;DR: 1,3,5-Trimethyl-2,4,6(1H,3H,5H)-pyrimidinetrione (CAS 7358-61-4) is a chemical compound with molecular formula C7H10N2O3 and molecular weight 170.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3,5-trimethyl-1,3-diazinane-2,4,6-trione
Also Known As: 1,3,5-Trimethylbarbituric acid, Barbituric acid, 1,3,5-trimethyl-, 1,3,5-trimethylbarbituricacid, 1,3,5-trimethyl-1,3-diazinane-2,4,6-trione, Barbituric acid,3,5-trimethyl-
| Molecular Formula | C7H10N2O3 |
|---|---|
| Molecular Weight | 170.07 g/mol |
| LogP | -0.2 |
| Topological Polar Surface Area | 57.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 170.06914 |
| Heavy Atoms | 12 |
| Complexity | 237.0 |
Chemical Identifiers
| CAS Number | 7358-61-4 |
|---|---|
| SMILES | CC1C(=O)N(C(=O)N(C1=O)C)C |
| InChIKey | OTSKHUNLOQPIGN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,3,5-Trimethyl-2,4,6(1H,3H,5H)-pyrimidinetrione (CAS 7358-61-4), with molecular formula C7H10N2O3 and molecular weight 170.07 g/mol. IUPAC: 1,3,5-trimethyl-1,3-diazinane-2,4,6-trione.
Chemical Property Profile of 1,3,5-Trimethyl-2,4,6(1H,3H,5H)-pyrimidinetrione
Property Insights of 1,3,5-Trimethyl-2,4,6(1H,3H,5H)-pyrimidinetrione
The XLogP value of -0.2 indicates that 1,3,5-Trimethyl-2,4,6(1H,3H,5H)-pyrimidinetrione is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 57.7 Ų, 1,3,5-Trimethyl-2,4,6(1H,3H,5H)-pyrimidinetrione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3,5-Trimethyl-2,4,6(1H,3H,5H)-pyrimidinetrione has 0 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 1,3,5-Trimethyl-2,4,6(1H,3H,5H)-pyrimidinetrione?
The CAS number of 1,3,5-Trimethyl-2,4,6(1H,3H,5H)-pyrimidinetrione is 7358-61-4.
What is the molecular formula of 1,3,5-Trimethyl-2,4,6(1H,3H,5H)-pyrimidinetrione?
The molecular formula of 1,3,5-Trimethyl-2,4,6(1H,3H,5H)-pyrimidinetrione is C7H10N2O3.
What is the molecular weight of 1,3,5-Trimethyl-2,4,6(1H,3H,5H)-pyrimidinetrione?
The molecular weight of 1,3,5-Trimethyl-2,4,6(1H,3H,5H)-pyrimidinetrione is 170.07 g/mol.
Where can I buy 1,3,5-Trimethyl-2,4,6(1H,3H,5H)-pyrimidinetrione?
You can request a quote for 1,3,5-Trimethyl-2,4,6(1H,3H,5H)-pyrimidinetrione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3,5-Trimethyl-2,4,6(1H,3H,5H)-pyrimidinetrione?
Yes, KEHONG BIO provides custom synthesis services for 1,3,5-Trimethyl-2,4,6(1H,3H,5H)-pyrimidinetrione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.