Barbituric acid, 5-methyl-5-(1-methyl-1-propenyl)-
TL;DR: Barbituric acid, 5-methyl-5-(1-methyl-1-propenyl)- (CAS 66843-06-9) is a chemical compound with molecular formula C9H12N2O3 and molecular weight 196.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(E)-but-2-en-2-yl]-5-methyl-1,3-diazinane-2,4,6-trione
Also Known As: 5-Methyl-5-(1-methyl-1-propenyl)barbituric acid, BARBITURIC ACID, 5-METHYL-5-(1-METHYL-1-PROPENYL)-, 4-24-00-01982 (Beilstein Handbook Reference), 5-(but-2-en-2-yl)-5-methyl-1,3-diazinane-2,4,6-trione, 5-[(E)-but-2-en-2-yl]-5-methyl-1,3-diazinane-2,4,6-trione
| Molecular Formula | C9H12N2O3 |
|---|---|
| Molecular Weight | 196.08 g/mol |
| LogP | 0.3249 |
| Topological Polar Surface Area | 75.27 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 196.0848 |
| Heavy Atoms | 14 |
| Complexity | 323.96622 |
Chemical Identifiers
| CAS Number | 66843-06-9 |
|---|---|
| SMILES | C/C=C(\C)/C1(C(=O)NC(=O)NC1=O)C |
Product Overview
Barbituric acid, 5-methyl-5-(1-methyl-1-propenyl)- (CAS 66843-06-9), with molecular formula C9H12N2O3 and molecular weight 196.08 g/mol. IUPAC: 5-[(E)-but-2-en-2-yl]-5-methyl-1,3-diazinane-2,4,6-trione.
Chemical Property Profile of Barbituric acid, 5-methyl-5-(1-methyl-1-propenyl)-
Property Insights of Barbituric acid, 5-methyl-5-(1-methyl-1-propenyl)-
The XLogP value of 0.3249 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Barbituric acid, 5-methyl-5-(1-methyl-1-propenyl)-. The TPSA of 75.27 Ų falls within the moderate polarity range, balancing permeability and solubility for Barbituric acid, 5-methyl-5-(1-methyl-1-propenyl)-. Following Lipinski's Rule of Five, Barbituric acid, 5-methyl-5-(1-methyl-1-propenyl)- 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 Barbituric acid, 5-methyl-5-(1-methyl-1-propenyl)-?
The CAS number of Barbituric acid, 5-methyl-5-(1-methyl-1-propenyl)- is 66843-06-9.
What is the molecular formula of Barbituric acid, 5-methyl-5-(1-methyl-1-propenyl)-?
The molecular formula of Barbituric acid, 5-methyl-5-(1-methyl-1-propenyl)- is C9H12N2O3.
What is the molecular weight of Barbituric acid, 5-methyl-5-(1-methyl-1-propenyl)-?
The molecular weight of Barbituric acid, 5-methyl-5-(1-methyl-1-propenyl)- is 196.08 g/mol.
Where can I buy Barbituric acid, 5-methyl-5-(1-methyl-1-propenyl)-?
You can request a quote for Barbituric acid, 5-methyl-5-(1-methyl-1-propenyl)- 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-methyl-5-(1-methyl-1-propenyl)-?
Yes, KEHONG BIO provides custom synthesis services for Barbituric acid, 5-methyl-5-(1-methyl-1-propenyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.