![5-[[3-(2-ethylhexoxy)propylamino]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione structure](/static/products/374/374543-47-2.png)
5-[[3-(2-ethylhexoxy)propylamino]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
TL;DR: 5-[[3-(2-ethylhexoxy)propylamino]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione (CAS 374543-47-2) is a chemical compound with molecular formula C16H27N3O3S and molecular weight 341.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[3-(2-ethylhexoxy)propyliminomethyl]-6-hydroxy-2-sulfanylidene-1H-pyrimidin-4-one
Also Known As: 5-[[3-(2-ethylhexoxy)propylamino]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione, 5-{[3-(2-Ethyl-hexyloxy)-propylamino]-methylene}-2-thioxo-dihydro-pyrimidine-4,6-dione, (5Z)-5-[({3-[(2-ethylhexyl)oxy]propyl}amino)methylidene]-6-hydroxy-2-sulfanylpyrimidin-4(5H)-one, 5-(((3-((2-ethylhexyl)oxy)propyl)amino)methylene)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
| Molecular Formula | C16H27N3O3S |
|---|---|
| Molecular Weight | 341.18 g/mol |
| LogP | 3.18009 |
| Topological Polar Surface Area | 90.47 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 11 |
| Exact Mass | 341.1773 |
| Heavy Atoms | 23 |
| Complexity | 594.9686 |
Chemical Identifiers
| CAS Number | 374543-47-2 |
|---|---|
| SMILES | CCCCC(CC)COCCCN=CC1=C(NC(=S)NC1=O)O |
Product Overview
5-[[3-(2-ethylhexoxy)propylamino]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione (CAS 374543-47-2), with molecular formula C16H27N3O3S and molecular weight 341.18 g/mol. IUPAC: 5-[3-(2-ethylhexoxy)propyliminomethyl]-6-hydroxy-2-sulfanylidene-1H-pyrimidin-4-one.
Chemical Property Profile of 5-[[3-(2-ethylhexoxy)propylamino]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
Property Insights of 5-[[3-(2-ethylhexoxy)propylamino]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
The XLogP value of 3.18009 indicates that 5-[[3-(2-ethylhexoxy)propylamino]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.47 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-[[3-(2-ethylhexoxy)propylamino]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione. Following Lipinski's Rule of Five, 5-[[3-(2-ethylhexoxy)propylamino]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione has 3 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 5-[[3-(2-ethylhexoxy)propylamino]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione?
The CAS number of 5-[[3-(2-ethylhexoxy)propylamino]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione is 374543-47-2.
What is the molecular formula of 5-[[3-(2-ethylhexoxy)propylamino]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione?
The molecular formula of 5-[[3-(2-ethylhexoxy)propylamino]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione is C16H27N3O3S.
What is the molecular weight of 5-[[3-(2-ethylhexoxy)propylamino]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione?
The molecular weight of 5-[[3-(2-ethylhexoxy)propylamino]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione is 341.18 g/mol.
Where can I buy 5-[[3-(2-ethylhexoxy)propylamino]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione?
You can request a quote for 5-[[3-(2-ethylhexoxy)propylamino]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-[[3-(2-ethylhexoxy)propylamino]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione?
Yes, KEHONG BIO provides custom synthesis services for 5-[[3-(2-ethylhexoxy)propylamino]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.