(E)-5-(((3-(diethylamino)propyl)amino)methylene)-1-(4-fluorophenethyl)pyrimidine-2,4,6(1H,3H,5H)-trione
TL;DR: (E)-5-(((3-(diethylamino)propyl)amino)methylene)-1-(4-fluorophenethyl)pyrimidine-2,4,6(1H,3H,5H)-trione (CAS 1164542-18-0) is a chemical compound with molecular formula C20H27FN4O3 and molecular weight 390.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[3-(diethylamino)propyliminomethyl]-1-[2-(4-fluorophenyl)ethyl]-6-hydroxypyrimidine-2,4-dione
Also Known As: (E)-5-(((3-(diethylamino)propyl)amino)methylene)-1-(4-fluorophenethyl)pyrimidine-2,4,6(1H,3H,5H)-trione, (5E)-5-({[3-(diethylamino)propyl]amino}methylidene)-3-[2-(4-fluorophenyl)ethyl]-6-hydroxypyrimidine-2,4(3H,5H)-dione, (5E)-5-[[3-(diethylamino)propylamino]methylidene]-1-[2-(4-fluorophenyl)ethyl]-1,3-diazinane-2,4,6-trione, 5-[[3-(diethylamino)propylamino]methylidene]-1-[2-(4-fluorophenyl)ethyl]-1,3-diazinane-2,4,6-trione
| Molecular Formula | C20H27FN4O3 |
|---|---|
| Molecular Weight | 390.21 g/mol |
| LogP | 1.7748 |
| Topological Polar Surface Area | 90.69 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 10 |
| Exact Mass | 390.20673 |
| Heavy Atoms | 28 |
| Complexity | 899.14734 |
Chemical Identifiers
| CAS Number | 1164542-18-0 |
|---|---|
| SMILES | CCN(CC)CCCN=CC1=C(N(C(=O)NC1=O)CCC2=CC=C(C=C2)F)O |
Product Overview
(E)-5-(((3-(diethylamino)propyl)amino)methylene)-1-(4-fluorophenethyl)pyrimidine-2,4,6(1H,3H,5H)-trione (CAS 1164542-18-0), with molecular formula C20H27FN4O3 and molecular weight 390.21 g/mol. IUPAC: 5-[3-(diethylamino)propyliminomethyl]-1-[2-(4-fluorophenyl)ethyl]-6-hydroxypyrimidine-2,4-dione.
Chemical Property Profile of (E)-5-(((3-(diethylamino)propyl)amino)methylene)-1-(4-fluorophenethyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Property Insights of (E)-5-(((3-(diethylamino)propyl)amino)methylene)-1-(4-fluorophenethyl)pyrimidine-2,4,6(1H,3H,5H)-trione
The XLogP value of 1.7748 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-5-(((3-(diethylamino)propyl)amino)methylene)-1-(4-fluorophenethyl)pyrimidine-2,4,6(1H,3H,5H)-trione. The TPSA of 90.69 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-5-(((3-(diethylamino)propyl)amino)methylene)-1-(4-fluorophenethyl)pyrimidine-2,4,6(1H,3H,5H)-trione. Following Lipinski's Rule of Five, (E)-5-(((3-(diethylamino)propyl)amino)methylene)-1-(4-fluorophenethyl)pyrimidine-2,4,6(1H,3H,5H)-trione has 2 hydrogen bond donor(s) and 5 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 (E)-5-(((3-(diethylamino)propyl)amino)methylene)-1-(4-fluorophenethyl)pyrimidine-2,4,6(1H,3H,5H)-trione?
The CAS number of (E)-5-(((3-(diethylamino)propyl)amino)methylene)-1-(4-fluorophenethyl)pyrimidine-2,4,6(1H,3H,5H)-trione is 1164542-18-0.
What is the molecular formula of (E)-5-(((3-(diethylamino)propyl)amino)methylene)-1-(4-fluorophenethyl)pyrimidine-2,4,6(1H,3H,5H)-trione?
The molecular formula of (E)-5-(((3-(diethylamino)propyl)amino)methylene)-1-(4-fluorophenethyl)pyrimidine-2,4,6(1H,3H,5H)-trione is C20H27FN4O3.
What is the molecular weight of (E)-5-(((3-(diethylamino)propyl)amino)methylene)-1-(4-fluorophenethyl)pyrimidine-2,4,6(1H,3H,5H)-trione?
The molecular weight of (E)-5-(((3-(diethylamino)propyl)amino)methylene)-1-(4-fluorophenethyl)pyrimidine-2,4,6(1H,3H,5H)-trione is 390.21 g/mol.
Where can I buy (E)-5-(((3-(diethylamino)propyl)amino)methylene)-1-(4-fluorophenethyl)pyrimidine-2,4,6(1H,3H,5H)-trione?
You can request a quote for (E)-5-(((3-(diethylamino)propyl)amino)methylene)-1-(4-fluorophenethyl)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 (E)-5-(((3-(diethylamino)propyl)amino)methylene)-1-(4-fluorophenethyl)pyrimidine-2,4,6(1H,3H,5H)-trione?
Yes, KEHONG BIO provides custom synthesis services for (E)-5-(((3-(diethylamino)propyl)amino)methylene)-1-(4-fluorophenethyl)pyrimidine-2,4,6(1H,3H,5H)-trione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.