Barbituric acid, 1,3-bis(acetoxymethyl)-5-ethyl-5-phenyl-
TL;DR: Barbituric acid, 1,3-bis(acetoxymethyl)-5-ethyl-5-phenyl- (CAS 27506-78-1) is a chemical compound with molecular formula C18H20N2O7 and molecular weight 376.12704 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[3-(acetyloxymethyl)-5-ethyl-2,4,6-trioxo-5-phenyl-1,3-diazinan-1-yl]methyl acetate
Also Known As: 1,3-Bis(acetoxymethyl)-5-ethyl-5-phenylbarbituric acid, BARBITURIC ACID, 1,3-BIS(ACETOXYMETHYL)-5-ETHYL-5-PHENYL-, 5-24-09-00292 (Beilstein Handbook Reference), (5-Ethyl-2,4,6-trioxo-5-phenyl-1,3-diazinane-1,3-diyl)bis(methylene) diacetate, [3-(acetyloxymethyl)-5-ethyl-2,4,6-trioxo-5-phenyl-1,3-diazinan-1-yl]methyl acetate
Technical Specifications
| Molecular Formula | C18H20N2O7 |
| Molecular Weight | 376.12704 g/mol |
| XLogP | 1.6 |
| Topological Polar Surface Area (TPSA) | 110.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 376.12704 Da |
| Heavy Atoms | 27 |
| Complexity | 600.0 |
| SMILES | CCC1(C(=O)N(C(=O)N(C1=O)COC(=O)C)COC(=O)C)C2=CC=CC=C2 |
| InChIKey | GUWJJPGXGXERJJ-UHFFFAOYSA-N |
Chemical Property Profile of Barbituric acid, 1,3-bis(acetoxymethyl)-5-ethyl-5-phenyl-
Property Insights of Barbituric acid, 1,3-bis(acetoxymethyl)-5-ethyl-5-phenyl-
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Barbituric acid, 1,3-bis(acetoxymethyl)-5-ethyl-5-phenyl-. The TPSA of 110.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Barbituric acid, 1,3-bis(acetoxymethyl)-5-ethyl-5-phenyl-. Following Lipinski's Rule of Five, Barbituric acid, 1,3-bis(acetoxymethyl)-5-ethyl-5-phenyl- has 0 hydrogen bond donor(s) and 7 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, 1,3-bis(acetoxymethyl)-5-ethyl-5-phenyl-?
The CAS number of Barbituric acid, 1,3-bis(acetoxymethyl)-5-ethyl-5-phenyl- is 27506-78-1.
What is the molecular formula of Barbituric acid, 1,3-bis(acetoxymethyl)-5-ethyl-5-phenyl-?
The molecular formula of Barbituric acid, 1,3-bis(acetoxymethyl)-5-ethyl-5-phenyl- is C18H20N2O7.
What is the molecular weight of Barbituric acid, 1,3-bis(acetoxymethyl)-5-ethyl-5-phenyl-?
The molecular weight of Barbituric acid, 1,3-bis(acetoxymethyl)-5-ethyl-5-phenyl- is 376.12704 g/mol.
Where can I buy Barbituric acid, 1,3-bis(acetoxymethyl)-5-ethyl-5-phenyl-?
You can request a quote for Barbituric acid, 1,3-bis(acetoxymethyl)-5-ethyl-5-phenyl- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Barbituric acid, 1,3-bis(acetoxymethyl)-5-ethyl-5-phenyl-?
Yes, CoreyChem provides custom synthesis services for Barbituric acid, 1,3-bis(acetoxymethyl)-5-ethyl-5-phenyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.