Barbituric acid, 5-ethyl-5-(methoxymethyl)-
TL;DR: Barbituric acid, 5-ethyl-5-(methoxymethyl)- (CAS 66968-68-1) is a chemical compound with molecular formula C8H12N2O4 and molecular weight 200.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-ethyl-5-(methoxymethyl)-1,3-diazinane-2,4,6-trione
Also Known As: NCIOpen2_001210, 5-Ethyl-5-(methoxymethyl)barbituric acid, BARBITURIC ACID, 5-ETHYL-5-(METHOXYMETHYL)-, 5-Ethyl-5- -2,4,6 -pyrimidinetrione, 5-25-03-00280 (Beilstein Handbook Reference)
| Molecular Formula | C8H12N2O4 |
|---|---|
| Molecular Weight | 200.08 g/mol |
| LogP | -0.6 |
| Topological Polar Surface Area | 84.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 200.07971 |
| Heavy Atoms | 14 |
| Complexity | 267.0 |
Chemical Identifiers
| CAS Number | 66968-68-1 |
|---|---|
| SMILES | CCC1(C(=O)NC(=O)NC1=O)COC |
| InChIKey | POJHSILFNQHBRV-UHFFFAOYSA-N |
Product Overview
Barbituric acid, 5-ethyl-5-(methoxymethyl)- (CAS 66968-68-1), with molecular formula C8H12N2O4 and molecular weight 200.08 g/mol. IUPAC: 5-ethyl-5-(methoxymethyl)-1,3-diazinane-2,4,6-trione.
Chemical Property Profile of Barbituric acid, 5-ethyl-5-(methoxymethyl)-
Property Insights of Barbituric acid, 5-ethyl-5-(methoxymethyl)-
The XLogP value of -0.6 indicates that Barbituric acid, 5-ethyl-5-(methoxymethyl)- is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 84.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Barbituric acid, 5-ethyl-5-(methoxymethyl)-. Following Lipinski's Rule of Five, Barbituric acid, 5-ethyl-5-(methoxymethyl)- 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 Barbituric acid, 5-ethyl-5-(methoxymethyl)-?
The CAS number of Barbituric acid, 5-ethyl-5-(methoxymethyl)- is 66968-68-1.
What is the molecular formula of Barbituric acid, 5-ethyl-5-(methoxymethyl)-?
The molecular formula of Barbituric acid, 5-ethyl-5-(methoxymethyl)- is C8H12N2O4.
What is the molecular weight of Barbituric acid, 5-ethyl-5-(methoxymethyl)-?
The molecular weight of Barbituric acid, 5-ethyl-5-(methoxymethyl)- is 200.08 g/mol.
Where can I buy Barbituric acid, 5-ethyl-5-(methoxymethyl)-?
You can request a quote for Barbituric acid, 5-ethyl-5-(methoxymethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Barbituric acid, 5-ethyl-5-(methoxymethyl)-?
Yes, KEHONG BIO provides custom synthesis services for Barbituric acid, 5-ethyl-5-(methoxymethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.