5-[(Benzylamino)methylidene]-1,3-dimethyl-1,3-diazinane-2,4,6-trione
TL;DR: 5-[(Benzylamino)methylidene]-1,3-dimethyl-1,3-diazinane-2,4,6-trione (CAS 338394-14-2) is a chemical compound with molecular formula C14H15N3O3 and molecular weight 273.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(benzyliminomethyl)-6-hydroxy-1,3-dimethylpyrimidine-2,4-dione
Also Known As: 5-[(benzylamino)methylidene]-1,3-dimethyl-1,3-diazinane-2,4,6-trione, BAS 01402945, 2B-096, 5-(benzyliminomethyl)-6-hydroxy-1,3-dimethylpyrimidine-2,4-dione, 5-[(benzylamino)methylene]-1,3-dimethyl-2,4,6(1H,3H,5H)-pyrimidinetrione
| Molecular Formula | C14H15N3O3 |
|---|---|
| Molecular Weight | 273.11 g/mol |
| LogP | 0.4087 |
| Topological Polar Surface Area | 76.59 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 273.11133 |
| Heavy Atoms | 20 |
| Complexity | 757.7141 |
Chemical Identifiers
| CAS Number | 338394-14-2 |
|---|---|
| SMILES | CN1C(=C(C(=O)N(C1=O)C)C=NCC2=CC=CC=C2)O |
Product Overview
5-[(Benzylamino)methylidene]-1,3-dimethyl-1,3-diazinane-2,4,6-trione (CAS 338394-14-2), with molecular formula C14H15N3O3 and molecular weight 273.11 g/mol. IUPAC: 5-(benzyliminomethyl)-6-hydroxy-1,3-dimethylpyrimidine-2,4-dione.
Chemical Property Profile of 5-[(Benzylamino)methylidene]-1,3-dimethyl-1,3-diazinane-2,4,6-trione
Property Insights of 5-[(Benzylamino)methylidene]-1,3-dimethyl-1,3-diazinane-2,4,6-trione
The XLogP value of 0.4087 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-[(Benzylamino)methylidene]-1,3-dimethyl-1,3-diazinane-2,4,6-trione. The TPSA of 76.59 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-[(Benzylamino)methylidene]-1,3-dimethyl-1,3-diazinane-2,4,6-trione. Following Lipinski's Rule of Five, 5-[(Benzylamino)methylidene]-1,3-dimethyl-1,3-diazinane-2,4,6-trione has 1 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-[(Benzylamino)methylidene]-1,3-dimethyl-1,3-diazinane-2,4,6-trione?
The CAS number of 5-[(Benzylamino)methylidene]-1,3-dimethyl-1,3-diazinane-2,4,6-trione is 338394-14-2.
What is the molecular formula of 5-[(Benzylamino)methylidene]-1,3-dimethyl-1,3-diazinane-2,4,6-trione?
The molecular formula of 5-[(Benzylamino)methylidene]-1,3-dimethyl-1,3-diazinane-2,4,6-trione is C14H15N3O3.
What is the molecular weight of 5-[(Benzylamino)methylidene]-1,3-dimethyl-1,3-diazinane-2,4,6-trione?
The molecular weight of 5-[(Benzylamino)methylidene]-1,3-dimethyl-1,3-diazinane-2,4,6-trione is 273.11 g/mol.
Where can I buy 5-[(Benzylamino)methylidene]-1,3-dimethyl-1,3-diazinane-2,4,6-trione?
You can request a quote for 5-[(Benzylamino)methylidene]-1,3-dimethyl-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-[(Benzylamino)methylidene]-1,3-dimethyl-1,3-diazinane-2,4,6-trione?
Yes, KEHONG BIO provides custom synthesis services for 5-[(Benzylamino)methylidene]-1,3-dimethyl-1,3-diazinane-2,4,6-trione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.