5-Isopropyl-5-(beta-hydroxypropyl)barbituric acid
TL;DR: 5-Isopropyl-5-(beta-hydroxypropyl)barbituric acid (CAS 33841-17-7) is a chemical compound with molecular formula C10H16N2O4 and molecular weight 228.11101 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-(2-hydroxypropyl)-5-propan-2-yl-1,3-diazinane-2,4,6-trione
Also Known As: Propallylonal M (des-Br, OH), 5-(2-Hydroxypropyl)-5-isopropylbarbituric acid, 5-Isopropyl-5-(beta-hydroxypropyl)barbituric acid, 4-25-00-00447 (Beilstein Handbook Reference), Kwas 5-izopropylo-5-(beta-hydroksy-propylo)-barbiturowy
Technical Specifications
| Molecular Formula | C10H16N2O4 |
| Molecular Weight | 228.11101 g/mol |
| XLogP | 0.2 |
| Topological Polar Surface Area (TPSA) | 95.5 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 228.11101 Da |
| Heavy Atoms | 16 |
| Complexity | 318.0 |
| SMILES | CC(C)C1(C(=O)NC(=O)NC1=O)CC(C)O |
| InChIKey | PKMMAWVSVCNKLQ-UHFFFAOYSA-N |
Chemical Property Profile of 5-Isopropyl-5-(beta-hydroxypropyl)barbituric acid
Property Insights of 5-Isopropyl-5-(beta-hydroxypropyl)barbituric acid
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Isopropyl-5-(beta-hydroxypropyl)barbituric acid. The TPSA of 95.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Isopropyl-5-(beta-hydroxypropyl)barbituric acid. Following Lipinski's Rule of Five, 5-Isopropyl-5-(beta-hydroxypropyl)barbituric acid has 3 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 5-Isopropyl-5-(beta-hydroxypropyl)barbituric acid?
The CAS number of 5-Isopropyl-5-(beta-hydroxypropyl)barbituric acid is 33841-17-7.
What is the molecular formula of 5-Isopropyl-5-(beta-hydroxypropyl)barbituric acid?
The molecular formula of 5-Isopropyl-5-(beta-hydroxypropyl)barbituric acid is C10H16N2O4.
What is the molecular weight of 5-Isopropyl-5-(beta-hydroxypropyl)barbituric acid?
The molecular weight of 5-Isopropyl-5-(beta-hydroxypropyl)barbituric acid is 228.11101 g/mol.
Where can I buy 5-Isopropyl-5-(beta-hydroxypropyl)barbituric acid?
You can request a quote for 5-Isopropyl-5-(beta-hydroxypropyl)barbituric acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 5-Isopropyl-5-(beta-hydroxypropyl)barbituric acid?
Yes, CoreyChem provides custom synthesis services for 5-Isopropyl-5-(beta-hydroxypropyl)barbituric acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.