![5-[1-[(4-fluorophenyl)methylamino]propylidene]-1-prop-2-enyl-1,3-diazinane-2,4,6-trione structure](/static/products/577/577787-85-0.png)
5-[1-[(4-fluorophenyl)methylamino]propylidene]-1-prop-2-enyl-1,3-diazinane-2,4,6-trione
TL;DR: 5-[1-[(4-fluorophenyl)methylamino]propylidene]-1-prop-2-enyl-1,3-diazinane-2,4,6-trione (CAS 577787-85-0) is a chemical compound with molecular formula C17H18FN3O3 and molecular weight 331.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[C-ethyl-N-[(4-fluorophenyl)methyl]carbonimidoyl]-6-hydroxy-1-prop-2-enylpyrimidine-2,4-dione
Also Known As: 5-[1-[(4-fluorophenyl)methylamino]propylidene]-1-prop-2-enyl-1,3-diazinane-2,4,6-trione, (E)-1-allyl-5-(1-((4-fluorobenzyl)amino)propylidene)pyrimidine-2,4,6(1H,3H,5H)-trione, (5E)-5-[1-[(4-fluorophenyl)methylamino]propylidene]-1-prop-2-enyl-1,3-diazinane-2,4,6-trione, (5E)-5-{1-[(4-fluorobenzyl)amino]propylidene}-6-hydroxy-3-(prop-2-en-1-yl)pyrimidine-2,4(3H,5H)-dione
| Molecular Formula | C17H18FN3O3 |
|---|---|
| Molecular Weight | 331.13 g/mol |
| LogP | 1.9666 |
| Topological Polar Surface Area | 87.45 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 331.1332 |
| Heavy Atoms | 24 |
| Complexity | 879.43427 |
Chemical Identifiers
| CAS Number | 577787-85-0 |
|---|---|
| SMILES | CCC(=NCC1=CC=C(C=C1)F)C2=C(N(C(=O)NC2=O)CC=C)O |
Product Overview
5-[1-[(4-fluorophenyl)methylamino]propylidene]-1-prop-2-enyl-1,3-diazinane-2,4,6-trione (CAS 577787-85-0), with molecular formula C17H18FN3O3 and molecular weight 331.13 g/mol. IUPAC: 5-[C-ethyl-N-[(4-fluorophenyl)methyl]carbonimidoyl]-6-hydroxy-1-prop-2-enylpyrimidine-2,4-dione.
Chemical Property Profile of 5-[1-[(4-fluorophenyl)methylamino]propylidene]-1-prop-2-enyl-1,3-diazinane-2,4,6-trione
Property Insights of 5-[1-[(4-fluorophenyl)methylamino]propylidene]-1-prop-2-enyl-1,3-diazinane-2,4,6-trione
The XLogP value of 1.9666 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-[1-[(4-fluorophenyl)methylamino]propylidene]-1-prop-2-enyl-1,3-diazinane-2,4,6-trione. The TPSA of 87.45 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-[1-[(4-fluorophenyl)methylamino]propylidene]-1-prop-2-enyl-1,3-diazinane-2,4,6-trione. Following Lipinski's Rule of Five, 5-[1-[(4-fluorophenyl)methylamino]propylidene]-1-prop-2-enyl-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 5-[1-[(4-fluorophenyl)methylamino]propylidene]-1-prop-2-enyl-1,3-diazinane-2,4,6-trione?
The CAS number of 5-[1-[(4-fluorophenyl)methylamino]propylidene]-1-prop-2-enyl-1,3-diazinane-2,4,6-trione is 577787-85-0.
What is the molecular formula of 5-[1-[(4-fluorophenyl)methylamino]propylidene]-1-prop-2-enyl-1,3-diazinane-2,4,6-trione?
The molecular formula of 5-[1-[(4-fluorophenyl)methylamino]propylidene]-1-prop-2-enyl-1,3-diazinane-2,4,6-trione is C17H18FN3O3.
What is the molecular weight of 5-[1-[(4-fluorophenyl)methylamino]propylidene]-1-prop-2-enyl-1,3-diazinane-2,4,6-trione?
The molecular weight of 5-[1-[(4-fluorophenyl)methylamino]propylidene]-1-prop-2-enyl-1,3-diazinane-2,4,6-trione is 331.13 g/mol.
Where can I buy 5-[1-[(4-fluorophenyl)methylamino]propylidene]-1-prop-2-enyl-1,3-diazinane-2,4,6-trione?
You can request a quote for 5-[1-[(4-fluorophenyl)methylamino]propylidene]-1-prop-2-enyl-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 5-[1-[(4-fluorophenyl)methylamino]propylidene]-1-prop-2-enyl-1,3-diazinane-2,4,6-trione?
Yes, KEHONG BIO provides custom synthesis services for 5-[1-[(4-fluorophenyl)methylamino]propylidene]-1-prop-2-enyl-1,3-diazinane-2,4,6-trione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.