Barbituric acid, 1,3-diphenyl-5-dodecyl-
TL;DR: Barbituric acid, 1,3-diphenyl-5-dodecyl- (CAS 73681-00-2) is a chemical compound with molecular formula C28H36N2O3 and molecular weight 448.27 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-dodecyl-1,3-diphenyl-1,3-diazinane-2,4,6-trione
Also Known As: 1,3-Diphenyl-5-dodecylbarbituric acid, BARBITURIC ACID, 1,3-DIPHENYL-5-DODECYL-, 5-24-09-00181 (Beilstein Handbook Reference), 5-dodecyl-1,3-diphenyl-1,3-diazinane-2,4,6-trione, 1,3-Diphenyl-5-dodecyl-2,4,6(1H,3H,5H)-pyrimidinetrione
| Molecular Formula | C28H36N2O3 |
|---|---|
| Molecular Weight | 448.27 g/mol |
| LogP | 8.7 |
| Topological Polar Surface Area | 57.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 13 |
| Exact Mass | 448.27258 |
| Heavy Atoms | 33 |
| Complexity | 583.0 |
Chemical Identifiers
| CAS Number | 73681-00-2 |
|---|---|
| SMILES | CCCCCCCCCCCCC1C(=O)N(C(=O)N(C1=O)C2=CC=CC=C2)C3=CC=CC=C3 |
| InChIKey | FDIQZTLQFGRADN-UHFFFAOYSA-N |
Product Overview
Barbituric acid, 1,3-diphenyl-5-dodecyl- (CAS 73681-00-2), with molecular formula C28H36N2O3 and molecular weight 448.27 g/mol. IUPAC: 5-dodecyl-1,3-diphenyl-1,3-diazinane-2,4,6-trione.
Chemical Property Profile of Barbituric acid, 1,3-diphenyl-5-dodecyl-
Property Insights of Barbituric acid, 1,3-diphenyl-5-dodecyl-
The XLogP value of 8.7 indicates that Barbituric acid, 1,3-diphenyl-5-dodecyl- 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, 1,3-diphenyl-5-dodecyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Barbituric acid, 1,3-diphenyl-5-dodecyl- has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Barbituric acid, 1,3-diphenyl-5-dodecyl-?
The CAS number of Barbituric acid, 1,3-diphenyl-5-dodecyl- is 73681-00-2.
What is the molecular formula of Barbituric acid, 1,3-diphenyl-5-dodecyl-?
The molecular formula of Barbituric acid, 1,3-diphenyl-5-dodecyl- is C28H36N2O3.
What is the molecular weight of Barbituric acid, 1,3-diphenyl-5-dodecyl-?
The molecular weight of Barbituric acid, 1,3-diphenyl-5-dodecyl- is 448.27 g/mol.
Where can I buy Barbituric acid, 1,3-diphenyl-5-dodecyl-?
You can request a quote for Barbituric acid, 1,3-diphenyl-5-dodecyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Barbituric acid, 1,3-diphenyl-5-dodecyl-?
Yes, KEHONG BIO provides custom synthesis services for Barbituric acid, 1,3-diphenyl-5-dodecyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.