Hexahydropyrimidine-2,4,6-trione, 5-butyryl-
TL;DR: Hexahydropyrimidine-2,4,6-trione, 5-butyryl- (CAS 58713-10-3) is a chemical compound with molecular formula C8H10N2O4 and molecular weight 198.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-butanoyl-1,3-diazinane-2,4,6-trione
Also Known As: 5-butyryl-pyrimidine-2,4,6-trione, 5-butanoyl-1,3-diazinane-2,4,6-trione, 5-butyrylpyrimidine-2,4,6(1H,3H,5H)-trione, Hexahydropyrimidine-2,4,6-trione, 5-butyryl-, 5-butanoylpyrimidine-2,4,6(1H,3H,5H)-trione
| Molecular Formula | C8H10N2O4 |
|---|---|
| Molecular Weight | 198.06 g/mol |
| LogP | -0.4 |
| Topological Polar Surface Area | 92.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 198.06406 |
| Heavy Atoms | 14 |
| Complexity | 290.0 |
Chemical Identifiers
| CAS Number | 58713-10-3 |
|---|---|
| SMILES | CCCC(=O)C1C(=O)NC(=O)NC1=O |
| InChIKey | IFQGVFRGDUUPOL-UHFFFAOYSA-N |
Product Overview
Hexahydropyrimidine-2,4,6-trione, 5-butyryl- (CAS 58713-10-3), with molecular formula C8H10N2O4 and molecular weight 198.06 g/mol. IUPAC: 5-butanoyl-1,3-diazinane-2,4,6-trione.
Chemical Property Profile of Hexahydropyrimidine-2,4,6-trione, 5-butyryl-
Property Insights of Hexahydropyrimidine-2,4,6-trione, 5-butyryl-
The XLogP value of -0.4 indicates that Hexahydropyrimidine-2,4,6-trione, 5-butyryl- is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 92.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Hexahydropyrimidine-2,4,6-trione, 5-butyryl-. Following Lipinski's Rule of Five, Hexahydropyrimidine-2,4,6-trione, 5-butyryl- has 2 hydrogen bond donor(s) and 4 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 Hexahydropyrimidine-2,4,6-trione, 5-butyryl-?
The CAS number of Hexahydropyrimidine-2,4,6-trione, 5-butyryl- is 58713-10-3.
What is the molecular formula of Hexahydropyrimidine-2,4,6-trione, 5-butyryl-?
The molecular formula of Hexahydropyrimidine-2,4,6-trione, 5-butyryl- is C8H10N2O4.
What is the molecular weight of Hexahydropyrimidine-2,4,6-trione, 5-butyryl-?
The molecular weight of Hexahydropyrimidine-2,4,6-trione, 5-butyryl- is 198.06 g/mol.
Where can I buy Hexahydropyrimidine-2,4,6-trione, 5-butyryl-?
You can request a quote for Hexahydropyrimidine-2,4,6-trione, 5-butyryl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Hexahydropyrimidine-2,4,6-trione, 5-butyryl-?
Yes, KEHONG BIO provides custom synthesis services for Hexahydropyrimidine-2,4,6-trione, 5-butyryl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.