Barbituric acid, 1-cyclohexyl-5,5-diallyl-3-phenyl-
TL;DR: Barbituric acid, 1-cyclohexyl-5,5-diallyl-3-phenyl- (CAS 53414-37-2) is a chemical compound with molecular formula C22H26N2O3 and molecular weight 366.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-cyclohexyl-3-phenyl-5,5-bis(prop-2-enyl)-1,3-diazinane-2,4,6-trione
Also Known As: 1-Cyclohexyl-5,5-diallyl-3-phenylbarbituric acid, 1-Phenyl-3-cyclohexyl-5,5-diallylbarbituric acid, BARBITURIC ACID, 1-CYCLOHEXYL-5,5-DIALLYL-3-PHENYL-, 5-24-09-00248 (Beilstein Handbook Reference), 1-cyclohexyl-3-phenyl-5,5-bis(prop-2-enyl)-1,3-diazinane-2,4,6-trione
| Molecular Formula | C22H26N2O3 |
|---|---|
| Molecular Weight | 366.19 g/mol |
| LogP | 4.6 |
| Topological Polar Surface Area | 57.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 366.19434 |
| Heavy Atoms | 27 |
| Complexity | 605.0 |
Chemical Identifiers
| CAS Number | 53414-37-2 |
|---|---|
| SMILES | C=CCC1(C(=O)N(C(=O)N(C1=O)C2=CC=CC=C2)C3CCCCC3)CC=C |
| InChIKey | IVSSDXBCDGDZMI-UHFFFAOYSA-N |
Product Overview
Barbituric acid, 1-cyclohexyl-5,5-diallyl-3-phenyl- (CAS 53414-37-2), with molecular formula C22H26N2O3 and molecular weight 366.19 g/mol. IUPAC: 1-cyclohexyl-3-phenyl-5,5-bis(prop-2-enyl)-1,3-diazinane-2,4,6-trione.
Chemical Property Profile of Barbituric acid, 1-cyclohexyl-5,5-diallyl-3-phenyl-
Property Insights of Barbituric acid, 1-cyclohexyl-5,5-diallyl-3-phenyl-
The XLogP value of 4.6 indicates that Barbituric acid, 1-cyclohexyl-5,5-diallyl-3-phenyl- 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, 1-cyclohexyl-5,5-diallyl-3-phenyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Barbituric acid, 1-cyclohexyl-5,5-diallyl-3-phenyl- 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, 1-cyclohexyl-5,5-diallyl-3-phenyl-?
The CAS number of Barbituric acid, 1-cyclohexyl-5,5-diallyl-3-phenyl- is 53414-37-2.
What is the molecular formula of Barbituric acid, 1-cyclohexyl-5,5-diallyl-3-phenyl-?
The molecular formula of Barbituric acid, 1-cyclohexyl-5,5-diallyl-3-phenyl- is C22H26N2O3.
What is the molecular weight of Barbituric acid, 1-cyclohexyl-5,5-diallyl-3-phenyl-?
The molecular weight of Barbituric acid, 1-cyclohexyl-5,5-diallyl-3-phenyl- is 366.19 g/mol.
Where can I buy Barbituric acid, 1-cyclohexyl-5,5-diallyl-3-phenyl-?
You can request a quote for Barbituric acid, 1-cyclohexyl-5,5-diallyl-3-phenyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Barbituric acid, 1-cyclohexyl-5,5-diallyl-3-phenyl-?
Yes, KEHONG BIO provides custom synthesis services for Barbituric acid, 1-cyclohexyl-5,5-diallyl-3-phenyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.