![(5E)-5-({[3-(4-fluorophenyl)-3-(furan-2-yl)propyl]amino}methylidene)-1-methyl-2-sulfanylpyrimidine-4,6(1H,5H)-dione structure](/static/products/714/714290-74-1.png)
(5E)-5-({[3-(4-fluorophenyl)-3-(furan-2-yl)propyl]amino}methylidene)-1-methyl-2-sulfanylpyrimidine-4,6(1H,5H)-dione
TL;DR: (5E)-5-({[3-(4-fluorophenyl)-3-(furan-2-yl)propyl]amino}methylidene)-1-methyl-2-sulfanylpyrimidine-4,6(1H,5H)-dione (CAS 714290-74-1) is a chemical compound with molecular formula C19H18FN3O3S and molecular weight 387.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[[3-(4-fluorophenyl)-3-(furan-2-yl)propyl]iminomethyl]-6-hydroxy-1-methyl-2-sulfanylidenepyrimidin-4-one
Also Known As: (5E)-5-({[3-(4-fluorophenyl)-3-(furan-2-yl)propyl]amino}methylidene)-1-methyl-2-sulfanylpyrimidine-4,6(1H,5H)-dione, (5E)-5-[[[3-(4-fluorophenyl)-3-(furan-2-yl)propyl]amino]methylidene]-1-methyl-2-sulfanylidene-1,3-diazinane-4,6-dione, (E)-5-(((3-(4-fluorophenyl)-3-(furan-2-yl)propyl)amino)methylene)-1-methyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione, 5-[[[3-(4-fluorophenyl)-3-(furan-2-yl)propyl]amino]methylidene]-1-methyl-2-sulfanylidene-1,3-diazinane-4,6-dione
| Molecular Formula | C19H18FN3O3S |
|---|---|
| Molecular Weight | 387.11 g/mol |
| LogP | 3.52169 |
| Topological Polar Surface Area | 83.52 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 387.1053 |
| Heavy Atoms | 27 |
| Complexity | 1053.2942 |
Chemical Identifiers
| CAS Number | 714290-74-1 |
|---|---|
| SMILES | CN1C(=C(C(=O)NC1=S)C=NCCC(C2=CC=C(C=C2)F)C3=CC=CO3)O |
Product Overview
(5E)-5-({[3-(4-fluorophenyl)-3-(furan-2-yl)propyl]amino}methylidene)-1-methyl-2-sulfanylpyrimidine-4,6(1H,5H)-dione (CAS 714290-74-1), with molecular formula C19H18FN3O3S and molecular weight 387.11 g/mol. IUPAC: 5-[[3-(4-fluorophenyl)-3-(furan-2-yl)propyl]iminomethyl]-6-hydroxy-1-methyl-2-sulfanylidenepyrimidin-4-one.
Chemical Property Profile of (5E)-5-({[3-(4-fluorophenyl)-3-(furan-2-yl)propyl]amino}methylidene)-1-methyl-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Property Insights of (5E)-5-({[3-(4-fluorophenyl)-3-(furan-2-yl)propyl]amino}methylidene)-1-methyl-2-sulfanylpyrimidine-4,6(1H,5H)-dione
The XLogP value of 3.52169 indicates that (5E)-5-({[3-(4-fluorophenyl)-3-(furan-2-yl)propyl]amino}methylidene)-1-methyl-2-sulfanylpyrimidine-4,6(1H,5H)-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.52 Ų falls within the moderate polarity range, balancing permeability and solubility for (5E)-5-({[3-(4-fluorophenyl)-3-(furan-2-yl)propyl]amino}methylidene)-1-methyl-2-sulfanylpyrimidine-4,6(1H,5H)-dione. Following Lipinski's Rule of Five, (5E)-5-({[3-(4-fluorophenyl)-3-(furan-2-yl)propyl]amino}methylidene)-1-methyl-2-sulfanylpyrimidine-4,6(1H,5H)-dione 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 (5E)-5-({[3-(4-fluorophenyl)-3-(furan-2-yl)propyl]amino}methylidene)-1-methyl-2-sulfanylpyrimidine-4,6(1H,5H)-dione?
The CAS number of (5E)-5-({[3-(4-fluorophenyl)-3-(furan-2-yl)propyl]amino}methylidene)-1-methyl-2-sulfanylpyrimidine-4,6(1H,5H)-dione is 714290-74-1.
What is the molecular formula of (5E)-5-({[3-(4-fluorophenyl)-3-(furan-2-yl)propyl]amino}methylidene)-1-methyl-2-sulfanylpyrimidine-4,6(1H,5H)-dione?
The molecular formula of (5E)-5-({[3-(4-fluorophenyl)-3-(furan-2-yl)propyl]amino}methylidene)-1-methyl-2-sulfanylpyrimidine-4,6(1H,5H)-dione is C19H18FN3O3S.
What is the molecular weight of (5E)-5-({[3-(4-fluorophenyl)-3-(furan-2-yl)propyl]amino}methylidene)-1-methyl-2-sulfanylpyrimidine-4,6(1H,5H)-dione?
The molecular weight of (5E)-5-({[3-(4-fluorophenyl)-3-(furan-2-yl)propyl]amino}methylidene)-1-methyl-2-sulfanylpyrimidine-4,6(1H,5H)-dione is 387.11 g/mol.
Where can I buy (5E)-5-({[3-(4-fluorophenyl)-3-(furan-2-yl)propyl]amino}methylidene)-1-methyl-2-sulfanylpyrimidine-4,6(1H,5H)-dione?
You can request a quote for (5E)-5-({[3-(4-fluorophenyl)-3-(furan-2-yl)propyl]amino}methylidene)-1-methyl-2-sulfanylpyrimidine-4,6(1H,5H)-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (5E)-5-({[3-(4-fluorophenyl)-3-(furan-2-yl)propyl]amino}methylidene)-1-methyl-2-sulfanylpyrimidine-4,6(1H,5H)-dione?
Yes, KEHONG BIO provides custom synthesis services for (5E)-5-({[3-(4-fluorophenyl)-3-(furan-2-yl)propyl]amino}methylidene)-1-methyl-2-sulfanylpyrimidine-4,6(1H,5H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.