Barbituric acid, 5,5-diethyl-1-(2-(2-methylmaleimido)ethyl)-
TL;DR: Barbituric acid, 5,5-diethyl-1-(2-(2-methylmaleimido)ethyl)- (CAS 55282-68-3) is a chemical compound with molecular formula C15H19N3O5 and molecular weight 321.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,5-diethyl-1-[2-(3-methyl-2,5-dioxopyrrol-1-yl)ethyl]-1,3-diazinane-2,4,6-trione
Also Known As: 3,3-Dimethylcyclohexyl chloride, 1-[2- ethyl]-5,5-diethylbarbituricacid, Barbituric acid, 5,5-diethyl-1-(2-(2-methylmaleimido)ethyl)-, 5-24-09-00149 (Beilstein Handbook Reference), 5,5-Diethyl-1-(2-(2-methylmaleimido)ethyl)barbituric acid
| Molecular Formula | C15H19N3O5 |
|---|---|
| Molecular Weight | 321.13 g/mol |
| LogP | 0.3 |
| Topological Polar Surface Area | 104.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 321.13248 |
| Heavy Atoms | 23 |
| Complexity | 633.0 |
Chemical Identifiers
| CAS Number | 55282-68-3 |
|---|---|
| SMILES | CCC1(C(=O)NC(=O)N(C1=O)CCN2C(=O)C=C(C2=O)C)CC |
| InChIKey | COIPJCGZRZRPFH-UHFFFAOYSA-N |
Product Overview
Barbituric acid, 5,5-diethyl-1-(2-(2-methylmaleimido)ethyl)- (CAS 55282-68-3), with molecular formula C15H19N3O5 and molecular weight 321.13 g/mol. IUPAC: 5,5-diethyl-1-[2-(3-methyl-2,5-dioxopyrrol-1-yl)ethyl]-1,3-diazinane-2,4,6-trione.
Chemical Property Profile of Barbituric acid, 5,5-diethyl-1-(2-(2-methylmaleimido)ethyl)-
Property Insights of Barbituric acid, 5,5-diethyl-1-(2-(2-methylmaleimido)ethyl)-
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Barbituric acid, 5,5-diethyl-1-(2-(2-methylmaleimido)ethyl)-. The TPSA of 104.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Barbituric acid, 5,5-diethyl-1-(2-(2-methylmaleimido)ethyl)-. Following Lipinski's Rule of Five, Barbituric acid, 5,5-diethyl-1-(2-(2-methylmaleimido)ethyl)- has 1 hydrogen bond donor(s) and 5 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, 5,5-diethyl-1-(2-(2-methylmaleimido)ethyl)-?
The CAS number of Barbituric acid, 5,5-diethyl-1-(2-(2-methylmaleimido)ethyl)- is 55282-68-3.
What is the molecular formula of Barbituric acid, 5,5-diethyl-1-(2-(2-methylmaleimido)ethyl)-?
The molecular formula of Barbituric acid, 5,5-diethyl-1-(2-(2-methylmaleimido)ethyl)- is C15H19N3O5.
What is the molecular weight of Barbituric acid, 5,5-diethyl-1-(2-(2-methylmaleimido)ethyl)-?
The molecular weight of Barbituric acid, 5,5-diethyl-1-(2-(2-methylmaleimido)ethyl)- is 321.13 g/mol.
Where can I buy Barbituric acid, 5,5-diethyl-1-(2-(2-methylmaleimido)ethyl)-?
You can request a quote for Barbituric acid, 5,5-diethyl-1-(2-(2-methylmaleimido)ethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Barbituric acid, 5,5-diethyl-1-(2-(2-methylmaleimido)ethyl)-?
Yes, KEHONG BIO provides custom synthesis services for Barbituric acid, 5,5-diethyl-1-(2-(2-methylmaleimido)ethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.