![5-[(4-Methylpentylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione structure](/static/products/5306/5306-89-8.webp)
5-[(4-Methylpentylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
TL;DR: 5-[(4-Methylpentylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione (CAS 5306-89-8) is a chemical compound with molecular formula C11H17N3O2S and molecular weight 255.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-hydroxy-5-(4-methylpentyliminomethyl)-2-sulfanylidene-1H-pyrimidin-4-one
Also Known As: AB00079766-01, 5-[(4-methylpentylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione, 5-{[(4-Methylpentyl)amino]methylidene}-2-sulfanylidene-1,3-diazinane-4,6-dione
| Molecular Formula | C11H17N3O2S |
|---|---|
| Molecular Weight | 255.10 g/mol |
| LogP | 1.99319 |
| Topological Polar Surface Area | 81.24 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 255.10414 |
| Heavy Atoms | 17 |
| Complexity | 502.1734 |
Chemical Identifiers
| CAS Number | 5306-89-8 |
|---|---|
| SMILES | CC(C)CCCN=CC1=C(NC(=S)NC1=O)O |
Product Overview
5-[(4-Methylpentylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione (CAS 5306-89-8), with molecular formula C11H17N3O2S and molecular weight 255.10 g/mol. IUPAC: 6-hydroxy-5-(4-methylpentyliminomethyl)-2-sulfanylidene-1H-pyrimidin-4-one.
Chemical Property Profile of 5-[(4-Methylpentylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
Property Insights of 5-[(4-Methylpentylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
The XLogP value of 1.99319 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-[(4-Methylpentylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione. The TPSA of 81.24 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-[(4-Methylpentylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione. Following Lipinski's Rule of Five, 5-[(4-Methylpentylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione has 3 hydrogen bond donor(s) and 4 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-[(4-Methylpentylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione?
The CAS number of 5-[(4-Methylpentylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione is 5306-89-8.
What is the molecular formula of 5-[(4-Methylpentylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione?
The molecular formula of 5-[(4-Methylpentylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione is C11H17N3O2S.
What is the molecular weight of 5-[(4-Methylpentylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione?
The molecular weight of 5-[(4-Methylpentylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione is 255.10 g/mol.
Where can I buy 5-[(4-Methylpentylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione?
You can request a quote for 5-[(4-Methylpentylamino)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-[(4-Methylpentylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione?
Yes, KEHONG BIO provides custom synthesis services for 5-[(4-Methylpentylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.