![1-cyclopropyl-5-[(oxolan-2-ylmethylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione structure](/static/products/573/573697-85-5.png)
1-cyclopropyl-5-[(oxolan-2-ylmethylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
TL;DR: 1-cyclopropyl-5-[(oxolan-2-ylmethylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione (CAS 573697-85-5) is a chemical compound with molecular formula C13H17N3O3S and molecular weight 295.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-cyclopropyl-6-hydroxy-5-(oxolan-2-ylmethyliminomethyl)-2-sulfanylidenepyrimidin-4-one
Also Known As: 1-cyclopropyl-5-[(oxolan-2-ylmethylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione, (5E)-1-cyclopropyl-2-sulfanyl-5-{[(tetrahydrofuran-2-ylmethyl)amino]methylidene}pyrimidine-4,6(1H,5H)-dione, (5E)-1-cyclopropyl-5-[(oxolan-2-ylmethylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione, (E)-1-cyclopropyl-5-((((tetrahydrofuran-2-yl)methyl)amino)methylene)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione, 1-Cyclopropyl-5-[1-[(tetrahydro-furan-2-ylmethyl)-amino]-meth-(E)-ylidene]-2-thioxo-dihydro-pyrimidine- 4,6-dione
| Molecular Formula | C13H17N3O3S |
|---|---|
| Molecular Weight | 295.10 g/mol |
| LogP | 1.54429 |
| Topological Polar Surface Area | 79.61 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 295.09906 |
| Heavy Atoms | 20 |
| Complexity | 639.24194 |
Chemical Identifiers
| CAS Number | 573697-85-5 |
|---|---|
| SMILES | C1CC(OC1)CN=CC2=C(N(C(=S)NC2=O)C3CC3)O |
Product Overview
1-cyclopropyl-5-[(oxolan-2-ylmethylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione (CAS 573697-85-5), with molecular formula C13H17N3O3S and molecular weight 295.10 g/mol. IUPAC: 1-cyclopropyl-6-hydroxy-5-(oxolan-2-ylmethyliminomethyl)-2-sulfanylidenepyrimidin-4-one.
Chemical Property Profile of 1-cyclopropyl-5-[(oxolan-2-ylmethylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
Property Insights of 1-cyclopropyl-5-[(oxolan-2-ylmethylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
The XLogP value of 1.54429 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-cyclopropyl-5-[(oxolan-2-ylmethylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione. The TPSA of 79.61 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-cyclopropyl-5-[(oxolan-2-ylmethylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione. Following Lipinski's Rule of Five, 1-cyclopropyl-5-[(oxolan-2-ylmethylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-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 1-cyclopropyl-5-[(oxolan-2-ylmethylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione?
The CAS number of 1-cyclopropyl-5-[(oxolan-2-ylmethylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione is 573697-85-5.
What is the molecular formula of 1-cyclopropyl-5-[(oxolan-2-ylmethylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione?
The molecular formula of 1-cyclopropyl-5-[(oxolan-2-ylmethylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione is C13H17N3O3S.
What is the molecular weight of 1-cyclopropyl-5-[(oxolan-2-ylmethylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione?
The molecular weight of 1-cyclopropyl-5-[(oxolan-2-ylmethylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione is 295.10 g/mol.
Where can I buy 1-cyclopropyl-5-[(oxolan-2-ylmethylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione?
You can request a quote for 1-cyclopropyl-5-[(oxolan-2-ylmethylamino)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-[(oxolan-2-ylmethylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione?
Yes, KEHONG BIO provides custom synthesis services for 1-cyclopropyl-5-[(oxolan-2-ylmethylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.