Dimethylamobarbital
TL;DR: Dimethylamobarbital (CAS 28239-46-5) is a chemical compound with molecular formula C13H22N2O3 and molecular weight 254.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-ethyl-1,3-dimethyl-5-(3-methylbutyl)-1,3-diazinane-2,4,6-trione
Also Known As: Dimethylamobarbital, N,N'-Dimethylamobarbital, Amobarbital permethylated, Amobarbital, (bis-Me), Amylobarbitone-permethylated
| Molecular Formula | C13H22N2O3 |
|---|---|
| Molecular Weight | 254.16 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 57.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 254.16304 |
| Heavy Atoms | 18 |
| Complexity | 352.0 |
Chemical Identifiers
| CAS Number | 28239-46-5 |
|---|---|
| SMILES | CCC1(C(=O)N(C(=O)N(C1=O)C)C)CCC(C)C |
| InChIKey | SETFOBQXPZJCGE-UHFFFAOYSA-N |
Product Overview
Dimethylamobarbital (CAS 28239-46-5), with molecular formula C13H22N2O3 and molecular weight 254.16 g/mol. IUPAC: 5-ethyl-1,3-dimethyl-5-(3-methylbutyl)-1,3-diazinane-2,4,6-trione.
Chemical Property Profile of Dimethylamobarbital
Property Insights of Dimethylamobarbital
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dimethylamobarbital. With a topological polar surface area (TPSA) of 57.7 Ų, Dimethylamobarbital exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dimethylamobarbital has 0 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 Dimethylamobarbital?
The CAS number of Dimethylamobarbital is 28239-46-5.
What is the molecular formula of Dimethylamobarbital?
The molecular formula of Dimethylamobarbital is C13H22N2O3.
What is the molecular weight of Dimethylamobarbital?
The molecular weight of Dimethylamobarbital is 254.16 g/mol.
Where can I buy Dimethylamobarbital?
You can request a quote for Dimethylamobarbital directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dimethylamobarbital?
Yes, KEHONG BIO provides custom synthesis services for Dimethylamobarbital and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.