(5E)-5-[(1-adamantylamino)methylidene]-1-phenyl-1,3-diazinane-2,4,6-trione
TL;DR: (5E)-5-[(1-adamantylamino)methylidene]-1-phenyl-1,3-diazinane-2,4,6-trione (CAS 312926-58-2) is a chemical compound with molecular formula C21H23N3O3 and molecular weight 365.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(1-adamantyliminomethyl)-6-hydroxy-1-phenylpyrimidine-2,4-dione
Also Known As: 5-[(1-adamantylamino)methylidene]-1-phenyl-1,3-diazinane-2,4,6-trione, (5E)-5-[(1-adamantylamino)methylidene]-1-phenyl-1,3-diazinane-2,4,6-trione, (5Z)-5-[(1-adamantylamino)methylidene]-1-phenyl-1,3-diazinane-2,4,6-trione, (5E)-1-phenyl-5-[(tricyclo[3.3.1.1~3,7~]dec-1-ylamino)methylidene]pyrimidine-2,4,6(1H,3H,5H)-trione, (E)-5-(((3s,5s,7s)-adamantan-1-ylamino)methylene)-1-phenylpyrimidine-2,4,6(1H,3H,5H)-trione
| Molecular Formula | C21H23N3O3 |
|---|---|
| Molecular Weight | 365.17 g/mol |
| LogP | 2.6191 |
| Topological Polar Surface Area | 87.45 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 365.17395 |
| Heavy Atoms | 27 |
| Complexity | 983.9185 |
Chemical Identifiers
| CAS Number | 312926-58-2 |
|---|---|
| SMILES | C1C2CC3CC1CC(C2)(C3)N=CC4=C(N(C(=O)NC4=O)C5=CC=CC=C5)O |
Product Overview
(5E)-5-[(1-adamantylamino)methylidene]-1-phenyl-1,3-diazinane-2,4,6-trione (CAS 312926-58-2), with molecular formula C21H23N3O3 and molecular weight 365.17 g/mol. IUPAC: 5-(1-adamantyliminomethyl)-6-hydroxy-1-phenylpyrimidine-2,4-dione.
Chemical Property Profile of (5E)-5-[(1-adamantylamino)methylidene]-1-phenyl-1,3-diazinane-2,4,6-trione
Property Insights of (5E)-5-[(1-adamantylamino)methylidene]-1-phenyl-1,3-diazinane-2,4,6-trione
The XLogP value of 2.6191 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (5E)-5-[(1-adamantylamino)methylidene]-1-phenyl-1,3-diazinane-2,4,6-trione. The TPSA of 87.45 Ų falls within the moderate polarity range, balancing permeability and solubility for (5E)-5-[(1-adamantylamino)methylidene]-1-phenyl-1,3-diazinane-2,4,6-trione. Following Lipinski's Rule of Five, (5E)-5-[(1-adamantylamino)methylidene]-1-phenyl-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 (5E)-5-[(1-adamantylamino)methylidene]-1-phenyl-1,3-diazinane-2,4,6-trione?
The CAS number of (5E)-5-[(1-adamantylamino)methylidene]-1-phenyl-1,3-diazinane-2,4,6-trione is 312926-58-2.
What is the molecular formula of (5E)-5-[(1-adamantylamino)methylidene]-1-phenyl-1,3-diazinane-2,4,6-trione?
The molecular formula of (5E)-5-[(1-adamantylamino)methylidene]-1-phenyl-1,3-diazinane-2,4,6-trione is C21H23N3O3.
What is the molecular weight of (5E)-5-[(1-adamantylamino)methylidene]-1-phenyl-1,3-diazinane-2,4,6-trione?
The molecular weight of (5E)-5-[(1-adamantylamino)methylidene]-1-phenyl-1,3-diazinane-2,4,6-trione is 365.17 g/mol.
Where can I buy (5E)-5-[(1-adamantylamino)methylidene]-1-phenyl-1,3-diazinane-2,4,6-trione?
You can request a quote for (5E)-5-[(1-adamantylamino)methylidene]-1-phenyl-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 (5E)-5-[(1-adamantylamino)methylidene]-1-phenyl-1,3-diazinane-2,4,6-trione?
Yes, KEHONG BIO provides custom synthesis services for (5E)-5-[(1-adamantylamino)methylidene]-1-phenyl-1,3-diazinane-2,4,6-trione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.