1-Cyclohexyl-5-ethyl-3-phenyl-2,4,6(1H,3H,5H)-pyrimidinetrione
TL;DR: 1-Cyclohexyl-5-ethyl-3-phenyl-2,4,6(1H,3H,5H)-pyrimidinetrione (CAS 1042-85-9) is a chemical compound with molecular formula C18H22N2O3 and molecular weight 314.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-cyclohexyl-5-ethyl-3-phenyl-1,3-diazinane-2,4,6-trione
Also Known As: 1-Cyclohexyl-5-ethyl-3-phenylbarbituric acid, 1-cyclohexyl-5-ethyl-3-phenyl-1,3-diazinane-2,4,6-trione, 5-24-09-00122 (Beilstein Handbook Reference), BARBITURIC ACID, 1-CYCLOHEXYL-5-ETHYL-3-PHENYL-, 1-Cyclohexyl-5-ethyl-3-phenyl-2,4,6(1H,3H,5H)-pyrimidinetrione
| Molecular Formula | C18H22N2O3 |
|---|---|
| Molecular Weight | 314.16 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 57.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 314.16306 |
| Heavy Atoms | 23 |
| Complexity | 479.0 |
Chemical Identifiers
| CAS Number | 1042-85-9 |
|---|---|
| SMILES | CCC1C(=O)N(C(=O)N(C1=O)C2=CC=CC=C2)C3CCCCC3 |
| InChIKey | VHGLHDSRPPOBQD-UHFFFAOYSA-N |
Product Overview
1-Cyclohexyl-5-ethyl-3-phenyl-2,4,6(1H,3H,5H)-pyrimidinetrione (CAS 1042-85-9), with molecular formula C18H22N2O3 and molecular weight 314.16 g/mol. IUPAC: 1-cyclohexyl-5-ethyl-3-phenyl-1,3-diazinane-2,4,6-trione.
Chemical Property Profile of 1-Cyclohexyl-5-ethyl-3-phenyl-2,4,6(1H,3H,5H)-pyrimidinetrione
Property Insights of 1-Cyclohexyl-5-ethyl-3-phenyl-2,4,6(1H,3H,5H)-pyrimidinetrione
The XLogP value of 3.5 indicates that 1-Cyclohexyl-5-ethyl-3-phenyl-2,4,6(1H,3H,5H)-pyrimidinetrione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.7 Ų, 1-Cyclohexyl-5-ethyl-3-phenyl-2,4,6(1H,3H,5H)-pyrimidinetrione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Cyclohexyl-5-ethyl-3-phenyl-2,4,6(1H,3H,5H)-pyrimidinetrione has 0 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 1-Cyclohexyl-5-ethyl-3-phenyl-2,4,6(1H,3H,5H)-pyrimidinetrione?
The CAS number of 1-Cyclohexyl-5-ethyl-3-phenyl-2,4,6(1H,3H,5H)-pyrimidinetrione is 1042-85-9.
What is the molecular formula of 1-Cyclohexyl-5-ethyl-3-phenyl-2,4,6(1H,3H,5H)-pyrimidinetrione?
The molecular formula of 1-Cyclohexyl-5-ethyl-3-phenyl-2,4,6(1H,3H,5H)-pyrimidinetrione is C18H22N2O3.
What is the molecular weight of 1-Cyclohexyl-5-ethyl-3-phenyl-2,4,6(1H,3H,5H)-pyrimidinetrione?
The molecular weight of 1-Cyclohexyl-5-ethyl-3-phenyl-2,4,6(1H,3H,5H)-pyrimidinetrione is 314.16 g/mol.
Where can I buy 1-Cyclohexyl-5-ethyl-3-phenyl-2,4,6(1H,3H,5H)-pyrimidinetrione?
You can request a quote for 1-Cyclohexyl-5-ethyl-3-phenyl-2,4,6(1H,3H,5H)-pyrimidinetrione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Cyclohexyl-5-ethyl-3-phenyl-2,4,6(1H,3H,5H)-pyrimidinetrione?
Yes, KEHONG BIO provides custom synthesis services for 1-Cyclohexyl-5-ethyl-3-phenyl-2,4,6(1H,3H,5H)-pyrimidinetrione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.