Barbituric acid, 5-ethyl-5-(piperidinomethyl)-, monohydrochloride
TL;DR: Barbituric acid, 5-ethyl-5-(piperidinomethyl)-, monohydrochloride (CAS 10502-04-2) is a chemical compound with molecular formula C12H20ClN3O3 and molecular weight 289.11932 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-ethyl-5-(piperidin-1-ylmethyl)-1,3-diazinane-2,4,6-trione;hydrochloride
Also Known As: Sch 3901, 5-Etil-5-piperidinometil malonilurea cloridrato, 5-Ethyl-5-(piperidinomethyl)barbituric acid hydrochloride, Barbituric acid, 5-ethyl-5-(piperidinomethyl)-, monohydrochloride, 5-Etil-5-piperidinometil malonilurea cloridrato [Italian]
Technical Specifications
| Molecular Formula | C12H20ClN3O3 |
| Molecular Weight | 289.11932 g/mol |
| XLogP | 0.6565 |
| Topological Polar Surface Area (TPSA) | 78.5 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 289.11932 Da |
| Heavy Atoms | 19 |
| Complexity | 355.0 |
| SMILES | CCC1(C(=O)NC(=O)NC1=O)CN2CCCCC2.Cl |
| InChIKey | QFVVXWSODXZAHA-UHFFFAOYSA-N |
Chemical Property Profile of Barbituric acid, 5-ethyl-5-(piperidinomethyl)-, monohydrochloride
Property Insights of Barbituric acid, 5-ethyl-5-(piperidinomethyl)-, monohydrochloride
The XLogP value of 0.6565 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Barbituric acid, 5-ethyl-5-(piperidinomethyl)-, monohydrochloride. The TPSA of 78.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Barbituric acid, 5-ethyl-5-(piperidinomethyl)-, monohydrochloride. Following Lipinski's Rule of Five, Barbituric acid, 5-ethyl-5-(piperidinomethyl)-, monohydrochloride has 3 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Barbituric acid, 5-ethyl-5-(piperidinomethyl)-, monohydrochloride?
The CAS number of Barbituric acid, 5-ethyl-5-(piperidinomethyl)-, monohydrochloride is 10502-04-2.
What is the molecular formula of Barbituric acid, 5-ethyl-5-(piperidinomethyl)-, monohydrochloride?
The molecular formula of Barbituric acid, 5-ethyl-5-(piperidinomethyl)-, monohydrochloride is C12H20ClN3O3.
What is the molecular weight of Barbituric acid, 5-ethyl-5-(piperidinomethyl)-, monohydrochloride?
The molecular weight of Barbituric acid, 5-ethyl-5-(piperidinomethyl)-, monohydrochloride is 289.11932 g/mol.
Where can I buy Barbituric acid, 5-ethyl-5-(piperidinomethyl)-, monohydrochloride?
You can request a quote for Barbituric acid, 5-ethyl-5-(piperidinomethyl)-, monohydrochloride directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Barbituric acid, 5-ethyl-5-(piperidinomethyl)-, monohydrochloride?
Yes, CoreyChem provides custom synthesis services for Barbituric acid, 5-ethyl-5-(piperidinomethyl)-, monohydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.