5-(But-2-en-2-yl)-5-ethyl-6-hydroxy-3-methylpyrimidine-2,4(3H,5H)-dione
TL;DR: 5-(But-2-en-2-yl)-5-ethyl-6-hydroxy-3-methylpyrimidine-2,4(3H,5H)-dione (CAS 66968-89-6) is a chemical compound with molecular formula C11H16N2O3 and molecular weight 224.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-but-2-en-2-yl-5-ethyl-1-methyl-1,3-diazinane-2,4,6-trione
Also Known As: 4-24-00-01988 (Beilstein Handbook Reference), 5-Ethyl-1-methyl-5-(1-methylpropenyl)barbituric acid, 5-but-2-en-2-yl-5-ethyl-1-methyl-1,3-diazinane-2,4,6-trione, BARBITURIC ACID, 5-ETHYL-1-METHYL-5-(1-METHYLPROPENYL)-, 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-ethyl-1-methyl-5-(1-methyl-1-propenyl)-
| Molecular Formula | C11H16N2O3 |
|---|---|
| Molecular Weight | 224.12 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 66.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 224.11609 |
| Heavy Atoms | 16 |
| Complexity | 387.0 |
Chemical Identifiers
| CAS Number | 66968-89-6 |
|---|---|
| SMILES | CCC1(C(=O)NC(=O)N(C1=O)C)C(=CC)C |
| InChIKey | NCVHDTCOFYKMMM-UHFFFAOYSA-N |
Product Overview
5-(But-2-en-2-yl)-5-ethyl-6-hydroxy-3-methylpyrimidine-2,4(3H,5H)-dione (CAS 66968-89-6), with molecular formula C11H16N2O3 and molecular weight 224.12 g/mol. IUPAC: 5-but-2-en-2-yl-5-ethyl-1-methyl-1,3-diazinane-2,4,6-trione.
Chemical Property Profile of 5-(But-2-en-2-yl)-5-ethyl-6-hydroxy-3-methylpyrimidine-2,4(3H,5H)-dione
Property Insights of 5-(But-2-en-2-yl)-5-ethyl-6-hydroxy-3-methylpyrimidine-2,4(3H,5H)-dione
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(But-2-en-2-yl)-5-ethyl-6-hydroxy-3-methylpyrimidine-2,4(3H,5H)-dione. The TPSA of 66.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(But-2-en-2-yl)-5-ethyl-6-hydroxy-3-methylpyrimidine-2,4(3H,5H)-dione. Following Lipinski's Rule of Five, 5-(But-2-en-2-yl)-5-ethyl-6-hydroxy-3-methylpyrimidine-2,4(3H,5H)-dione has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5-(But-2-en-2-yl)-5-ethyl-6-hydroxy-3-methylpyrimidine-2,4(3H,5H)-dione?
The CAS number of 5-(But-2-en-2-yl)-5-ethyl-6-hydroxy-3-methylpyrimidine-2,4(3H,5H)-dione is 66968-89-6.
What is the molecular formula of 5-(But-2-en-2-yl)-5-ethyl-6-hydroxy-3-methylpyrimidine-2,4(3H,5H)-dione?
The molecular formula of 5-(But-2-en-2-yl)-5-ethyl-6-hydroxy-3-methylpyrimidine-2,4(3H,5H)-dione is C11H16N2O3.
What is the molecular weight of 5-(But-2-en-2-yl)-5-ethyl-6-hydroxy-3-methylpyrimidine-2,4(3H,5H)-dione?
The molecular weight of 5-(But-2-en-2-yl)-5-ethyl-6-hydroxy-3-methylpyrimidine-2,4(3H,5H)-dione is 224.12 g/mol.
Where can I buy 5-(But-2-en-2-yl)-5-ethyl-6-hydroxy-3-methylpyrimidine-2,4(3H,5H)-dione?
You can request a quote for 5-(But-2-en-2-yl)-5-ethyl-6-hydroxy-3-methylpyrimidine-2,4(3H,5H)-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(But-2-en-2-yl)-5-ethyl-6-hydroxy-3-methylpyrimidine-2,4(3H,5H)-dione?
Yes, KEHONG BIO provides custom synthesis services for 5-(But-2-en-2-yl)-5-ethyl-6-hydroxy-3-methylpyrimidine-2,4(3H,5H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.