2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-(3,7-dimethyloctyl)-
TL;DR: 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-(3,7-dimethyloctyl)- (CAS 101098-71-9) is a chemical compound with molecular formula C14H24N2O3 and molecular weight 268.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(3,7-dimethyloctyl)-1,3-diazinane-2,4,6-trione
Also Known As: 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-(3,7-dimethyloctyl)-, 5-(3,7-dimethyloctyl)-1,3-diazinane-2,4,6-trione, J1.041.614K, 5-(3,7-dimethyloctyl)pyrimidine-2,4,6(1H,3H,5H)-trione
| Molecular Formula | C14H24N2O3 |
|---|---|
| Molecular Weight | 268.18 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 75.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 268.17868 |
| Heavy Atoms | 19 |
| Complexity | 333.0 |
Chemical Identifiers
| CAS Number | 101098-71-9 |
|---|---|
| SMILES | CC(C)CCCC(C)CCC1C(=O)NC(=O)NC1=O |
| InChIKey | LTNFEXOLEMCQMK-UHFFFAOYSA-N |
Product Overview
2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-(3,7-dimethyloctyl)- (CAS 101098-71-9), with molecular formula C14H24N2O3 and molecular weight 268.18 g/mol. IUPAC: 5-(3,7-dimethyloctyl)-1,3-diazinane-2,4,6-trione.
Chemical Property Profile of 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-(3,7-dimethyloctyl)-
Property Insights of 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-(3,7-dimethyloctyl)-
The XLogP value of 3.4 indicates that 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-(3,7-dimethyloctyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-(3,7-dimethyloctyl)-. Following Lipinski's Rule of Five, 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-(3,7-dimethyloctyl)- has 2 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 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-(3,7-dimethyloctyl)-?
The CAS number of 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-(3,7-dimethyloctyl)- is 101098-71-9.
What is the molecular formula of 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-(3,7-dimethyloctyl)-?
The molecular formula of 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-(3,7-dimethyloctyl)- is C14H24N2O3.
What is the molecular weight of 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-(3,7-dimethyloctyl)-?
The molecular weight of 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-(3,7-dimethyloctyl)- is 268.18 g/mol.
Where can I buy 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-(3,7-dimethyloctyl)-?
You can request a quote for 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-(3,7-dimethyloctyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-(3,7-dimethyloctyl)-?
Yes, KEHONG BIO provides custom synthesis services for 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-(3,7-dimethyloctyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.