1-(2-phenylethyl)pyrimidine-2,4,6(1H,3H,5H)-trione
TL;DR: 1-(2-phenylethyl)pyrimidine-2,4,6(1H,3H,5H)-trione (CAS 251468-79-8) is a chemical compound with molecular formula C12H12N2O3 and molecular weight 232.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-phenylethyl)-1,3-diazinane-2,4,6-trione
Also Known As: 1-(2-phenylethyl)pyrimidine-2,4,6(1H,3H,5H)-trione, 1-(2-phenylethyl)-1,3-diazinane-2,4,6-trione, 1-Phenethyl-pyrimidine-2,4,6-trione, BAS 02374589, 1-phenethyl-1,3-diazinane-2,4,6-trione
| Molecular Formula | C12H12N2O3 |
|---|---|
| Molecular Weight | 232.08 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 66.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 232.0848 |
| Heavy Atoms | 17 |
| Complexity | 335.0 |
Chemical Identifiers
| CAS Number | 251468-79-8 |
|---|---|
| SMILES | C1C(=O)NC(=O)N(C1=O)CCC2=CC=CC=C2 |
| InChIKey | MHIKXQXNKSZIGX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 13 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-(2-phenylethyl)pyrimidine-2,4,6(1H,3H,5H)-trione (CAS 251468-79-8), with molecular formula C12H12N2O3 and molecular weight 232.08 g/mol. IUPAC: 1-(2-phenylethyl)-1,3-diazinane-2,4,6-trione.
Chemical Property Profile of 1-(2-phenylethyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Property Insights of 1-(2-phenylethyl)pyrimidine-2,4,6(1H,3H,5H)-trione
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2-phenylethyl)pyrimidine-2,4,6(1H,3H,5H)-trione. The TPSA of 66.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(2-phenylethyl)pyrimidine-2,4,6(1H,3H,5H)-trione. Following Lipinski's Rule of Five, 1-(2-phenylethyl)pyrimidine-2,4,6(1H,3H,5H)-trione 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 1-(2-phenylethyl)pyrimidine-2,4,6(1H,3H,5H)-trione?
The CAS number of 1-(2-phenylethyl)pyrimidine-2,4,6(1H,3H,5H)-trione is 251468-79-8.
What is the molecular formula of 1-(2-phenylethyl)pyrimidine-2,4,6(1H,3H,5H)-trione?
The molecular formula of 1-(2-phenylethyl)pyrimidine-2,4,6(1H,3H,5H)-trione is C12H12N2O3.
What is the molecular weight of 1-(2-phenylethyl)pyrimidine-2,4,6(1H,3H,5H)-trione?
The molecular weight of 1-(2-phenylethyl)pyrimidine-2,4,6(1H,3H,5H)-trione is 232.08 g/mol.
Where can I buy 1-(2-phenylethyl)pyrimidine-2,4,6(1H,3H,5H)-trione?
You can request a quote for 1-(2-phenylethyl)pyrimidine-2,4,6(1H,3H,5H)-trione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2-phenylethyl)pyrimidine-2,4,6(1H,3H,5H)-trione?
Yes, KEHONG BIO provides custom synthesis services for 1-(2-phenylethyl)pyrimidine-2,4,6(1H,3H,5H)-trione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.