5-pentyl-5-(propan-2-yl)pyrimidine-2,4,6(1H,3H,5H)-trione
TL;DR: 5-pentyl-5-(propan-2-yl)pyrimidine-2,4,6(1H,3H,5H)-trione (CAS 67051-42-7) is a chemical compound with molecular formula C12H20N2O3 and molecular weight 240.1474 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-pentyl-5-propan-2-yl-1,3-diazinane-2,4,6-trione
Also Known As: 5-Isopropyl-5-pentylbarbituric acid, 5-isopropyl-5-pentyl-barbituric acid, 5-pentyl-5-propan-2-yl-1,3-diazinane-2,4,6-trione, 5-pentyl-5-(propan-2-yl)-1,3-diazinane-2,4,6-trione, 5-pentyl-5-(propan-2-yl)pyrimidine-2,4,6(1H,3H,5H)-trione
Technical Specifications
| Molecular Formula | C12H20N2O3 |
| Molecular Weight | 240.1474 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 75.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 240.1474 Da |
| Heavy Atoms | 17 |
| Complexity | 317.0 |
| SMILES | CCCCCC1(C(=O)NC(=O)NC1=O)C(C)C |
| InChIKey | BWIWBKPXIWYKEZ-UHFFFAOYSA-N |
Chemical Property Profile of 5-pentyl-5-(propan-2-yl)pyrimidine-2,4,6(1H,3H,5H)-trione
Property Insights of 5-pentyl-5-(propan-2-yl)pyrimidine-2,4,6(1H,3H,5H)-trione
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-pentyl-5-(propan-2-yl)pyrimidine-2,4,6(1H,3H,5H)-trione. The TPSA of 75.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-pentyl-5-(propan-2-yl)pyrimidine-2,4,6(1H,3H,5H)-trione. Following Lipinski's Rule of Five, 5-pentyl-5-(propan-2-yl)pyrimidine-2,4,6(1H,3H,5H)-trione has 2 hydrogen bond donor(s) and 3 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-pentyl-5-(propan-2-yl)pyrimidine-2,4,6(1H,3H,5H)-trione?
The CAS number of 5-pentyl-5-(propan-2-yl)pyrimidine-2,4,6(1H,3H,5H)-trione is 67051-42-7.
What is the molecular formula of 5-pentyl-5-(propan-2-yl)pyrimidine-2,4,6(1H,3H,5H)-trione?
The molecular formula of 5-pentyl-5-(propan-2-yl)pyrimidine-2,4,6(1H,3H,5H)-trione is C12H20N2O3.
What is the molecular weight of 5-pentyl-5-(propan-2-yl)pyrimidine-2,4,6(1H,3H,5H)-trione?
The molecular weight of 5-pentyl-5-(propan-2-yl)pyrimidine-2,4,6(1H,3H,5H)-trione is 240.1474 g/mol.
Where can I buy 5-pentyl-5-(propan-2-yl)pyrimidine-2,4,6(1H,3H,5H)-trione?
You can request a quote for 5-pentyl-5-(propan-2-yl)pyrimidine-2,4,6(1H,3H,5H)-trione directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 5-pentyl-5-(propan-2-yl)pyrimidine-2,4,6(1H,3H,5H)-trione?
Yes, CoreyChem provides custom synthesis services for 5-pentyl-5-(propan-2-yl)pyrimidine-2,4,6(1H,3H,5H)-trione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.