![(5Z)-1-[2-(cyclohex-1-en-1-yl)ethyl]-5-{[(furan-2-ylmethyl)amino]methylidene}-2-sulfanylpyrimidine-4,6(1H,5H)-dione structure](/static/products/579/579446-56-3.png)
(5Z)-1-[2-(cyclohex-1-en-1-yl)ethyl]-5-{[(furan-2-ylmethyl)amino]methylidene}-2-sulfanylpyrimidine-4,6(1H,5H)-dione
TL;DR: (5Z)-1-[2-(cyclohex-1-en-1-yl)ethyl]-5-{[(furan-2-ylmethyl)amino]methylidene}-2-sulfanylpyrimidine-4,6(1H,5H)-dione (CAS 579446-56-3) is a chemical compound with molecular formula C18H21N3O3S and molecular weight 359.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[2-(cyclohexen-1-yl)ethyl]-5-(furan-2-ylmethyliminomethyl)-6-hydroxy-2-sulfanylidenepyrimidin-4-one
Also Known As: (5Z)-1-[2-(cyclohex-1-en-1-yl)ethyl]-5-{[(furan-2-ylmethyl)amino]methylidene}-2-sulfanylpyrimidine-4,6(1H,5H)-dione, (5Z)-1-[2-(cyclohexen-1-yl)ethyl]-5-[(furan-2-ylmethylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione, (Z)-1-(2-(cyclohex-1-en-1-yl)ethyl)-5-(((furan-2-ylmethyl)amino)methylene)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione, 1-[2-(cyclohexen-1-yl)ethyl]-5-[(furan-2-ylmethylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
| Molecular Formula | C18H21N3O3S |
|---|---|
| Molecular Weight | 359.13 g/mol |
| LogP | 3.71409 |
| Topological Polar Surface Area | 83.52 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 359.13037 |
| Heavy Atoms | 25 |
| Complexity | 891.2755 |
Chemical Identifiers
| CAS Number | 579446-56-3 |
|---|---|
| SMILES | C1CCC(=CC1)CCN2C(=C(C(=O)NC2=S)C=NCC3=CC=CO3)O |
Product Overview
(5Z)-1-[2-(cyclohex-1-en-1-yl)ethyl]-5-{[(furan-2-ylmethyl)amino]methylidene}-2-sulfanylpyrimidine-4,6(1H,5H)-dione (CAS 579446-56-3), with molecular formula C18H21N3O3S and molecular weight 359.13 g/mol. IUPAC: 1-[2-(cyclohexen-1-yl)ethyl]-5-(furan-2-ylmethyliminomethyl)-6-hydroxy-2-sulfanylidenepyrimidin-4-one.
Chemical Property Profile of (5Z)-1-[2-(cyclohex-1-en-1-yl)ethyl]-5-{[(furan-2-ylmethyl)amino]methylidene}-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Property Insights of (5Z)-1-[2-(cyclohex-1-en-1-yl)ethyl]-5-{[(furan-2-ylmethyl)amino]methylidene}-2-sulfanylpyrimidine-4,6(1H,5H)-dione
The XLogP value of 3.71409 indicates that (5Z)-1-[2-(cyclohex-1-en-1-yl)ethyl]-5-{[(furan-2-ylmethyl)amino]methylidene}-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 (5Z)-1-[2-(cyclohex-1-en-1-yl)ethyl]-5-{[(furan-2-ylmethyl)amino]methylidene}-2-sulfanylpyrimidine-4,6(1H,5H)-dione. Following Lipinski's Rule of Five, (5Z)-1-[2-(cyclohex-1-en-1-yl)ethyl]-5-{[(furan-2-ylmethyl)amino]methylidene}-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 (5Z)-1-[2-(cyclohex-1-en-1-yl)ethyl]-5-{[(furan-2-ylmethyl)amino]methylidene}-2-sulfanylpyrimidine-4,6(1H,5H)-dione?
The CAS number of (5Z)-1-[2-(cyclohex-1-en-1-yl)ethyl]-5-{[(furan-2-ylmethyl)amino]methylidene}-2-sulfanylpyrimidine-4,6(1H,5H)-dione is 579446-56-3.
What is the molecular formula of (5Z)-1-[2-(cyclohex-1-en-1-yl)ethyl]-5-{[(furan-2-ylmethyl)amino]methylidene}-2-sulfanylpyrimidine-4,6(1H,5H)-dione?
The molecular formula of (5Z)-1-[2-(cyclohex-1-en-1-yl)ethyl]-5-{[(furan-2-ylmethyl)amino]methylidene}-2-sulfanylpyrimidine-4,6(1H,5H)-dione is C18H21N3O3S.
What is the molecular weight of (5Z)-1-[2-(cyclohex-1-en-1-yl)ethyl]-5-{[(furan-2-ylmethyl)amino]methylidene}-2-sulfanylpyrimidine-4,6(1H,5H)-dione?
The molecular weight of (5Z)-1-[2-(cyclohex-1-en-1-yl)ethyl]-5-{[(furan-2-ylmethyl)amino]methylidene}-2-sulfanylpyrimidine-4,6(1H,5H)-dione is 359.13 g/mol.
Where can I buy (5Z)-1-[2-(cyclohex-1-en-1-yl)ethyl]-5-{[(furan-2-ylmethyl)amino]methylidene}-2-sulfanylpyrimidine-4,6(1H,5H)-dione?
You can request a quote for (5Z)-1-[2-(cyclohex-1-en-1-yl)ethyl]-5-{[(furan-2-ylmethyl)amino]methylidene}-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 (5Z)-1-[2-(cyclohex-1-en-1-yl)ethyl]-5-{[(furan-2-ylmethyl)amino]methylidene}-2-sulfanylpyrimidine-4,6(1H,5H)-dione?
Yes, KEHONG BIO provides custom synthesis services for (5Z)-1-[2-(cyclohex-1-en-1-yl)ethyl]-5-{[(furan-2-ylmethyl)amino]methylidene}-2-sulfanylpyrimidine-4,6(1H,5H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.