CTK8J9534
TL;DR: CTK8J9534 (CAS 66942-11-8) is a chemical compound with molecular formula C11H13BrN2O3 and molecular weight 300.01096 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-(2-bromoprop-2-enyl)-5-(2-methylprop-2-enyl)-1,3-diazinane-2,4,6-trione
Also Known As: 5- -5- -2,4,6 -pyrimidinetrione, BARBITURIC ACID, 5-(2-BROMOALLYL)-5-(2-METHYLALLYL)-, 5-(2-Bromo-2-propenyl)-5-(2-methyl-2-propenyl)barbituric acid, 5-(2-bromoprop-2-en-1-yl)-5-(2-methylprop-2-en-1-yl)-1,3-diazinane-2,4,6-trione, 5-(2-Bromoprop-2-en-1-yl)-5-(2-methylprop-2-en-1-yl)pyrimidine-2,4,6(1H,3H,5H)-trione
Technical Specifications
| Molecular Formula | C11H13BrN2O3 |
| Molecular Weight | 300.01096 g/mol |
| XLogP | 2.0 |
| Topological Polar Surface Area (TPSA) | 75.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 300.01096 Da |
| Heavy Atoms | 17 |
| Complexity | 408.0 |
| SMILES | CC(=C)CC1(C(=O)NC(=O)NC1=O)CC(=C)Br |
| InChIKey | ZKPRRHNKRILFMZ-UHFFFAOYSA-N |
Chemical Property Profile of CTK8J9534
Property Insights of CTK8J9534
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for CTK8J9534. The TPSA of 75.3 Ų falls within the moderate polarity range, balancing permeability and solubility for CTK8J9534. Following Lipinski's Rule of Five, CTK8J9534 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 CTK8J9534?
The CAS number of CTK8J9534 is 66942-11-8.
What is the molecular formula of CTK8J9534?
The molecular formula of CTK8J9534 is C11H13BrN2O3.
What is the molecular weight of CTK8J9534?
The molecular weight of CTK8J9534 is 300.01096 g/mol.
Where can I buy CTK8J9534?
You can request a quote for CTK8J9534 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for CTK8J9534?
Yes, CoreyChem provides custom synthesis services for CTK8J9534 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.