![1,3-dimethyl-5-[1-[[3-(octylamino)phenyl]amino]ethylidene]-1,3-diazinane-2,4,6-trione structure](/static/products/304/304872-30-8.png)
1,3-dimethyl-5-[1-[[3-(octylamino)phenyl]amino]ethylidene]-1,3-diazinane-2,4,6-trione
TL;DR: 1,3-dimethyl-5-[1-[[3-(octylamino)phenyl]amino]ethylidene]-1,3-diazinane-2,4,6-trione (CAS 304872-30-8) is a chemical compound with molecular formula C22H32N4O3 and molecular weight 400.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-hydroxy-1,3-dimethyl-5-[C-methyl-N-[3-(octylamino)phenyl]carbonimidoyl]pyrimidine-2,4-dione
Also Known As: 1,3-dimethyl-5-[1-[[3-(octylamino)phenyl]amino]ethylidene]-1,3-diazinane-2,4,6-trione, 1,3-dimethyl-5-[1-[3-(octylamino)anilino]ethylidene]-1,3-diazinane-2,4,6-trione, 1,3-dimethyl-5-(1-((3-(octylamino)phenyl)amino)ethylidene)pyrimidine-2,4,6(1H,3H,5H)-trione
| Molecular Formula | C22H32N4O3 |
|---|---|
| Molecular Weight | 400.25 g/mol |
| LogP | 3.7027 |
| Topological Polar Surface Area | 88.62 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 10 |
| Exact Mass | 400.24744 |
| Heavy Atoms | 29 |
| Complexity | 972.9983 |
Chemical Identifiers
| CAS Number | 304872-30-8 |
|---|---|
| SMILES | CCCCCCCCNC1=CC(=CC=C1)N=C(C)C2=C(N(C(=O)N(C2=O)C)C)O |
Product Overview
1,3-dimethyl-5-[1-[[3-(octylamino)phenyl]amino]ethylidene]-1,3-diazinane-2,4,6-trione (CAS 304872-30-8), with molecular formula C22H32N4O3 and molecular weight 400.25 g/mol. IUPAC: 6-hydroxy-1,3-dimethyl-5-[C-methyl-N-[3-(octylamino)phenyl]carbonimidoyl]pyrimidine-2,4-dione.
Chemical Property Profile of 1,3-dimethyl-5-[1-[[3-(octylamino)phenyl]amino]ethylidene]-1,3-diazinane-2,4,6-trione
Property Insights of 1,3-dimethyl-5-[1-[[3-(octylamino)phenyl]amino]ethylidene]-1,3-diazinane-2,4,6-trione
The XLogP value of 3.7027 indicates that 1,3-dimethyl-5-[1-[[3-(octylamino)phenyl]amino]ethylidene]-1,3-diazinane-2,4,6-trione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.62 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3-dimethyl-5-[1-[[3-(octylamino)phenyl]amino]ethylidene]-1,3-diazinane-2,4,6-trione. Following Lipinski's Rule of Five, 1,3-dimethyl-5-[1-[[3-(octylamino)phenyl]amino]ethylidene]-1,3-diazinane-2,4,6-trione 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 1,3-dimethyl-5-[1-[[3-(octylamino)phenyl]amino]ethylidene]-1,3-diazinane-2,4,6-trione?
The CAS number of 1,3-dimethyl-5-[1-[[3-(octylamino)phenyl]amino]ethylidene]-1,3-diazinane-2,4,6-trione is 304872-30-8.
What is the molecular formula of 1,3-dimethyl-5-[1-[[3-(octylamino)phenyl]amino]ethylidene]-1,3-diazinane-2,4,6-trione?
The molecular formula of 1,3-dimethyl-5-[1-[[3-(octylamino)phenyl]amino]ethylidene]-1,3-diazinane-2,4,6-trione is C22H32N4O3.
What is the molecular weight of 1,3-dimethyl-5-[1-[[3-(octylamino)phenyl]amino]ethylidene]-1,3-diazinane-2,4,6-trione?
The molecular weight of 1,3-dimethyl-5-[1-[[3-(octylamino)phenyl]amino]ethylidene]-1,3-diazinane-2,4,6-trione is 400.25 g/mol.
Where can I buy 1,3-dimethyl-5-[1-[[3-(octylamino)phenyl]amino]ethylidene]-1,3-diazinane-2,4,6-trione?
You can request a quote for 1,3-dimethyl-5-[1-[[3-(octylamino)phenyl]amino]ethylidene]-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 1,3-dimethyl-5-[1-[[3-(octylamino)phenyl]amino]ethylidene]-1,3-diazinane-2,4,6-trione?
Yes, KEHONG BIO provides custom synthesis services for 1,3-dimethyl-5-[1-[[3-(octylamino)phenyl]amino]ethylidene]-1,3-diazinane-2,4,6-trione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.