5-(Hept-2-en-2-yl)-4,6-dihydroxy-5-methylpyrimidin-2(5H)-one
TL;DR: 5-(Hept-2-en-2-yl)-4,6-dihydroxy-5-methylpyrimidin-2(5H)-one (CAS 66843-03-6) is a chemical compound with molecular formula C12H18N2O3 and molecular weight 238.13174 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-hept-2-en-2-yl-5-methyl-1,3-diazinane-2,4,6-trione
Also Known As: Barbituric acid, 5-methyl-5-(1-methyl-1-hexenyl), 5-hept-2-en-2-yl-5-methyl-1,3-diazinane-2,4,6-trione, 5-(Hept-2-en-2-yl)-4,6-dihydroxy-5-methylpyrimidin-2(5H)-one
Technical Specifications
| Molecular Formula | C12H18N2O3 |
| Molecular Weight | 238.13174 g/mol |
| XLogP | 2.4 |
| Topological Polar Surface Area (TPSA) | 75.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 238.13174 Da |
| Heavy Atoms | 17 |
| Complexity | 365.0 |
| SMILES | CCCCC=C(C)C1(C(=O)NC(=O)NC1=O)C |
| InChIKey | COHXZXCRMADMTH-UHFFFAOYSA-N |
Chemical Property Profile of 5-(Hept-2-en-2-yl)-4,6-dihydroxy-5-methylpyrimidin-2(5H)-one
Property Insights of 5-(Hept-2-en-2-yl)-4,6-dihydroxy-5-methylpyrimidin-2(5H)-one
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(Hept-2-en-2-yl)-4,6-dihydroxy-5-methylpyrimidin-2(5H)-one. The TPSA of 75.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(Hept-2-en-2-yl)-4,6-dihydroxy-5-methylpyrimidin-2(5H)-one. Following Lipinski's Rule of Five, 5-(Hept-2-en-2-yl)-4,6-dihydroxy-5-methylpyrimidin-2(5H)-one 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-(Hept-2-en-2-yl)-4,6-dihydroxy-5-methylpyrimidin-2(5H)-one?
The CAS number of 5-(Hept-2-en-2-yl)-4,6-dihydroxy-5-methylpyrimidin-2(5H)-one is 66843-03-6.
What is the molecular formula of 5-(Hept-2-en-2-yl)-4,6-dihydroxy-5-methylpyrimidin-2(5H)-one?
The molecular formula of 5-(Hept-2-en-2-yl)-4,6-dihydroxy-5-methylpyrimidin-2(5H)-one is C12H18N2O3.
What is the molecular weight of 5-(Hept-2-en-2-yl)-4,6-dihydroxy-5-methylpyrimidin-2(5H)-one?
The molecular weight of 5-(Hept-2-en-2-yl)-4,6-dihydroxy-5-methylpyrimidin-2(5H)-one is 238.13174 g/mol.
Where can I buy 5-(Hept-2-en-2-yl)-4,6-dihydroxy-5-methylpyrimidin-2(5H)-one?
You can request a quote for 5-(Hept-2-en-2-yl)-4,6-dihydroxy-5-methylpyrimidin-2(5H)-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 5-(Hept-2-en-2-yl)-4,6-dihydroxy-5-methylpyrimidin-2(5H)-one?
Yes, CoreyChem provides custom synthesis services for 5-(Hept-2-en-2-yl)-4,6-dihydroxy-5-methylpyrimidin-2(5H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.