Barbituric acid, 5-(3,3-dimethylallyl)-1,3-diphenyl-
TL;DR: Barbituric acid, 5-(3,3-dimethylallyl)-1,3-diphenyl- (CAS 73680-99-6) is a chemical compound with molecular formula C21H20N2O3 and molecular weight 348.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(3-methylbut-2-enyl)-1,3-diphenyl-1,3-diazinane-2,4,6-trione
Also Known As: 5-(3,3-Dimethylallyl)-1,3-diphenylbarbituric acid, BARBITURIC ACID, 5-(3,3-DIMETHYLALLYL)-1,3-DIPHENYL-, 5-24-09-00221 (Beilstein Handbook Reference), 5-(3-Methyl-2-butenyl)-1,3-diphenylbarbituric acid, 5-(3-methylbut-2-en-1-yl)-1,3-diphenyl-1,3-diazinane-2,4,6-trione
| Molecular Formula | C21H20N2O3 |
|---|---|
| Molecular Weight | 348.15 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 57.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 348.1474 |
| Heavy Atoms | 26 |
| Complexity | 542.0 |
Chemical Identifiers
| CAS Number | 73680-99-6 |
|---|---|
| SMILES | CC(=CCC1C(=O)N(C(=O)N(C1=O)C2=CC=CC=C2)C3=CC=CC=C3)C |
| InChIKey | DJYKVVADYPSQRV-UHFFFAOYSA-N |
Product Overview
Barbituric acid, 5-(3,3-dimethylallyl)-1,3-diphenyl- (CAS 73680-99-6), with molecular formula C21H20N2O3 and molecular weight 348.15 g/mol. IUPAC: 5-(3-methylbut-2-enyl)-1,3-diphenyl-1,3-diazinane-2,4,6-trione.
Chemical Property Profile of Barbituric acid, 5-(3,3-dimethylallyl)-1,3-diphenyl-
Property Insights of Barbituric acid, 5-(3,3-dimethylallyl)-1,3-diphenyl-
The XLogP value of 4.3 indicates that Barbituric acid, 5-(3,3-dimethylallyl)-1,3-diphenyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.7 Ų, Barbituric acid, 5-(3,3-dimethylallyl)-1,3-diphenyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Barbituric acid, 5-(3,3-dimethylallyl)-1,3-diphenyl- 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 Barbituric acid, 5-(3,3-dimethylallyl)-1,3-diphenyl-?
The CAS number of Barbituric acid, 5-(3,3-dimethylallyl)-1,3-diphenyl- is 73680-99-6.
What is the molecular formula of Barbituric acid, 5-(3,3-dimethylallyl)-1,3-diphenyl-?
The molecular formula of Barbituric acid, 5-(3,3-dimethylallyl)-1,3-diphenyl- is C21H20N2O3.
What is the molecular weight of Barbituric acid, 5-(3,3-dimethylallyl)-1,3-diphenyl-?
The molecular weight of Barbituric acid, 5-(3,3-dimethylallyl)-1,3-diphenyl- is 348.15 g/mol.
Where can I buy Barbituric acid, 5-(3,3-dimethylallyl)-1,3-diphenyl-?
You can request a quote for Barbituric acid, 5-(3,3-dimethylallyl)-1,3-diphenyl- 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-(3,3-dimethylallyl)-1,3-diphenyl-?
Yes, KEHONG BIO provides custom synthesis services for Barbituric acid, 5-(3,3-dimethylallyl)-1,3-diphenyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.