![5-[(cyclopropylamino)methylidene]-1-phenethyl-1,3-diazinane-2,4,6-trione structure](/static/products/577/577985-45-6.png)
5-[(cyclopropylamino)methylidene]-1-phenethyl-1,3-diazinane-2,4,6-trione
TL;DR: 5-[(cyclopropylamino)methylidene]-1-phenethyl-1,3-diazinane-2,4,6-trione (CAS 577985-45-6) is a chemical compound with molecular formula C16H17N3O3 and molecular weight 299.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(cyclopropyliminomethyl)-6-hydroxy-1-(2-phenylethyl)pyrimidine-2,4-dione
Also Known As: 5-[(cyclopropylamino)methylidene]-1-phenethyl-1,3-diazinane-2,4,6-trione, (5E)-5-[(cyclopropylamino)methylidene]-1-phenethyl-1,3-diazinane-2,4,6-trione, (E)-5-((cyclopropylamino)methylene)-1-phenethylpyrimidine-2,4,6(1H,3H,5H)-trione, 5-[1-Cyclopropylamino-meth-(E)-ylidene]-1-phenethyl-pyrimidine-2,4,6-trione, (5E)-5-[(cyclopropylamino)methylidene]-6-hydroxy-3-(2-phenylethyl)pyrimidine-2,4(3H,5H)-dione
| Molecular Formula | C16H17N3O3 |
|---|---|
| Molecular Weight | 299.13 g/mol |
| LogP | 1.0662 |
| Topological Polar Surface Area | 87.45 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 299.12698 |
| Heavy Atoms | 22 |
| Complexity | 801.6211 |
Chemical Identifiers
| CAS Number | 577985-45-6 |
|---|---|
| SMILES | C1CC1N=CC2=C(N(C(=O)NC2=O)CCC3=CC=CC=C3)O |
Product Overview
5-[(cyclopropylamino)methylidene]-1-phenethyl-1,3-diazinane-2,4,6-trione (CAS 577985-45-6), with molecular formula C16H17N3O3 and molecular weight 299.13 g/mol. IUPAC: 5-(cyclopropyliminomethyl)-6-hydroxy-1-(2-phenylethyl)pyrimidine-2,4-dione.
Chemical Property Profile of 5-[(cyclopropylamino)methylidene]-1-phenethyl-1,3-diazinane-2,4,6-trione
Property Insights of 5-[(cyclopropylamino)methylidene]-1-phenethyl-1,3-diazinane-2,4,6-trione
The XLogP value of 1.0662 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-[(cyclopropylamino)methylidene]-1-phenethyl-1,3-diazinane-2,4,6-trione. The TPSA of 87.45 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-[(cyclopropylamino)methylidene]-1-phenethyl-1,3-diazinane-2,4,6-trione. Following Lipinski's Rule of Five, 5-[(cyclopropylamino)methylidene]-1-phenethyl-1,3-diazinane-2,4,6-trione has 2 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-[(cyclopropylamino)methylidene]-1-phenethyl-1,3-diazinane-2,4,6-trione?
The CAS number of 5-[(cyclopropylamino)methylidene]-1-phenethyl-1,3-diazinane-2,4,6-trione is 577985-45-6.
What is the molecular formula of 5-[(cyclopropylamino)methylidene]-1-phenethyl-1,3-diazinane-2,4,6-trione?
The molecular formula of 5-[(cyclopropylamino)methylidene]-1-phenethyl-1,3-diazinane-2,4,6-trione is C16H17N3O3.
What is the molecular weight of 5-[(cyclopropylamino)methylidene]-1-phenethyl-1,3-diazinane-2,4,6-trione?
The molecular weight of 5-[(cyclopropylamino)methylidene]-1-phenethyl-1,3-diazinane-2,4,6-trione is 299.13 g/mol.
Where can I buy 5-[(cyclopropylamino)methylidene]-1-phenethyl-1,3-diazinane-2,4,6-trione?
You can request a quote for 5-[(cyclopropylamino)methylidene]-1-phenethyl-1,3-diazinane-2,4,6-trione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-[(cyclopropylamino)methylidene]-1-phenethyl-1,3-diazinane-2,4,6-trione?
Yes, KEHONG BIO provides custom synthesis services for 5-[(cyclopropylamino)methylidene]-1-phenethyl-1,3-diazinane-2,4,6-trione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.