![(5E)-1-butyl-5-[1-[(4-fluorophenyl)methylamino]propylidene]-1,3-diazinane-2,4,6-trione structure](/static/products/116/1164537-18-1.png)
(5E)-1-butyl-5-[1-[(4-fluorophenyl)methylamino]propylidene]-1,3-diazinane-2,4,6-trione
TL;DR: (5E)-1-butyl-5-[1-[(4-fluorophenyl)methylamino]propylidene]-1,3-diazinane-2,4,6-trione (CAS 1164537-18-1) is a chemical compound with molecular formula C18H22FN3O3 and molecular weight 347.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-butyl-5-[C-ethyl-N-[(4-fluorophenyl)methyl]carbonimidoyl]-6-hydroxypyrimidine-2,4-dione
Also Known As: (5E)-1-butyl-5-[1-[(4-fluorophenyl)methylamino]propylidene]-1,3-diazinane-2,4,6-trione, (E)-1-butyl-5-(1-((4-fluorobenzyl)amino)propylidene)pyrimidine-2,4,6(1H,3H,5H)-trione, 1-Butyl-5-[1-(4-fluoro-benzylamino)-prop-(E)-ylidene]-pyrimidine-2,4,6-trione, 1-butyl-5-[1-[(4-fluorophenyl)methylamino]propylidene]-1,3-diazinane-2,4,6-trione, (5Z)-3-butyl-5-{1-[(4-fluorobenzyl)amino]propylidene}-6-hydroxypyrimidine-2,4(3H,5H)-dione
| Molecular Formula | C18H22FN3O3 |
|---|---|
| Molecular Weight | 347.16 g/mol |
| LogP | 2.5807 |
| Topological Polar Surface Area | 87.45 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 347.16452 |
| Heavy Atoms | 25 |
| Complexity | 866.61554 |
Chemical Identifiers
| CAS Number | 1164537-18-1 |
|---|---|
| SMILES | CCCCN1C(=C(C(=O)NC1=O)C(=NCC2=CC=C(C=C2)F)CC)O |
Product Overview
(5E)-1-butyl-5-[1-[(4-fluorophenyl)methylamino]propylidene]-1,3-diazinane-2,4,6-trione (CAS 1164537-18-1), with molecular formula C18H22FN3O3 and molecular weight 347.16 g/mol. IUPAC: 1-butyl-5-[C-ethyl-N-[(4-fluorophenyl)methyl]carbonimidoyl]-6-hydroxypyrimidine-2,4-dione.
Chemical Property Profile of (5E)-1-butyl-5-[1-[(4-fluorophenyl)methylamino]propylidene]-1,3-diazinane-2,4,6-trione
Property Insights of (5E)-1-butyl-5-[1-[(4-fluorophenyl)methylamino]propylidene]-1,3-diazinane-2,4,6-trione
The XLogP value of 2.5807 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (5E)-1-butyl-5-[1-[(4-fluorophenyl)methylamino]propylidene]-1,3-diazinane-2,4,6-trione. The TPSA of 87.45 Ų falls within the moderate polarity range, balancing permeability and solubility for (5E)-1-butyl-5-[1-[(4-fluorophenyl)methylamino]propylidene]-1,3-diazinane-2,4,6-trione. Following Lipinski's Rule of Five, (5E)-1-butyl-5-[1-[(4-fluorophenyl)methylamino]propylidene]-1,3-diazinane-2,4,6-trione has 2 hydrogen bond donor(s) and 4 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 (5E)-1-butyl-5-[1-[(4-fluorophenyl)methylamino]propylidene]-1,3-diazinane-2,4,6-trione?
The CAS number of (5E)-1-butyl-5-[1-[(4-fluorophenyl)methylamino]propylidene]-1,3-diazinane-2,4,6-trione is 1164537-18-1.
What is the molecular formula of (5E)-1-butyl-5-[1-[(4-fluorophenyl)methylamino]propylidene]-1,3-diazinane-2,4,6-trione?
The molecular formula of (5E)-1-butyl-5-[1-[(4-fluorophenyl)methylamino]propylidene]-1,3-diazinane-2,4,6-trione is C18H22FN3O3.
What is the molecular weight of (5E)-1-butyl-5-[1-[(4-fluorophenyl)methylamino]propylidene]-1,3-diazinane-2,4,6-trione?
The molecular weight of (5E)-1-butyl-5-[1-[(4-fluorophenyl)methylamino]propylidene]-1,3-diazinane-2,4,6-trione is 347.16 g/mol.
Where can I buy (5E)-1-butyl-5-[1-[(4-fluorophenyl)methylamino]propylidene]-1,3-diazinane-2,4,6-trione?
You can request a quote for (5E)-1-butyl-5-[1-[(4-fluorophenyl)methylamino]propylidene]-1,3-diazinane-2,4,6-trione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (5E)-1-butyl-5-[1-[(4-fluorophenyl)methylamino]propylidene]-1,3-diazinane-2,4,6-trione?
Yes, KEHONG BIO provides custom synthesis services for (5E)-1-butyl-5-[1-[(4-fluorophenyl)methylamino]propylidene]-1,3-diazinane-2,4,6-trione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.