![1-cyclopropyl-5-[(2-piperazin-1-ylethylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione structure](/static/products/573/573696-95-4.png)
1-cyclopropyl-5-[(2-piperazin-1-ylethylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
TL;DR: 1-cyclopropyl-5-[(2-piperazin-1-ylethylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione (CAS 573696-95-4) is a chemical compound with molecular formula C14H21N5O2S and molecular weight 323.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-cyclopropyl-6-hydroxy-5-(2-piperazin-1-ylethyliminomethyl)-2-sulfanylidenepyrimidin-4-one
Also Known As: 1-cyclopropyl-5-[(2-piperazin-1-ylethylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione, (5E)-1-cyclopropyl-5-({[2-(piperazin-1-yl)ethyl]amino}methylidene)-2-sulfanylpyrimidine-4,6(1H,5H)-dione, (5E)-1-cyclopropyl-5-[(2-piperazin-1-ylethylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione, (E)-1-cyclopropyl-5-(((2-(piperazin-1-yl)ethyl)amino)methylene)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
| Molecular Formula | C14H21N5O2S |
|---|---|
| Molecular Weight | 323.14 g/mol |
| LogP | 0.27049 |
| Topological Polar Surface Area | 85.65 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 323.1416 |
| Heavy Atoms | 22 |
| Complexity | 670.79126 |
Chemical Identifiers
| CAS Number | 573696-95-4 |
|---|---|
| SMILES | C1CC1N2C(=C(C(=O)NC2=S)C=NCCN3CCNCC3)O |
Product Overview
1-cyclopropyl-5-[(2-piperazin-1-ylethylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione (CAS 573696-95-4), with molecular formula C14H21N5O2S and molecular weight 323.14 g/mol. IUPAC: 1-cyclopropyl-6-hydroxy-5-(2-piperazin-1-ylethyliminomethyl)-2-sulfanylidenepyrimidin-4-one.
Chemical Property Profile of 1-cyclopropyl-5-[(2-piperazin-1-ylethylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
Property Insights of 1-cyclopropyl-5-[(2-piperazin-1-ylethylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
The XLogP value of 0.27049 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-cyclopropyl-5-[(2-piperazin-1-ylethylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione. The TPSA of 85.65 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-cyclopropyl-5-[(2-piperazin-1-ylethylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione. Following Lipinski's Rule of Five, 1-cyclopropyl-5-[(2-piperazin-1-ylethylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione has 3 hydrogen bond donor(s) and 6 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 1-cyclopropyl-5-[(2-piperazin-1-ylethylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione?
The CAS number of 1-cyclopropyl-5-[(2-piperazin-1-ylethylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione is 573696-95-4.
What is the molecular formula of 1-cyclopropyl-5-[(2-piperazin-1-ylethylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione?
The molecular formula of 1-cyclopropyl-5-[(2-piperazin-1-ylethylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione is C14H21N5O2S.
What is the molecular weight of 1-cyclopropyl-5-[(2-piperazin-1-ylethylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione?
The molecular weight of 1-cyclopropyl-5-[(2-piperazin-1-ylethylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione is 323.14 g/mol.
Where can I buy 1-cyclopropyl-5-[(2-piperazin-1-ylethylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione?
You can request a quote for 1-cyclopropyl-5-[(2-piperazin-1-ylethylamino)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 1-cyclopropyl-5-[(2-piperazin-1-ylethylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione?
Yes, KEHONG BIO provides custom synthesis services for 1-cyclopropyl-5-[(2-piperazin-1-ylethylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.