![5-[1-(4-propan-2-ylanilino)propylidene]-1,3-diazinane-2,4,6-trione structure](/static/products/714/714946-46-0.png)
5-[1-(4-propan-2-ylanilino)propylidene]-1,3-diazinane-2,4,6-trione
TL;DR: 5-[1-(4-propan-2-ylanilino)propylidene]-1,3-diazinane-2,4,6-trione (CAS 714946-46-0) is a chemical compound with molecular formula C16H19N3O3 and molecular weight 301.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[C-ethyl-N-(4-propan-2-ylphenyl)carbonimidoyl]-6-hydroxy-1H-pyrimidine-2,4-dione
Also Known As: 5-[1-(4-propan-2-ylanilino)propylidene]-1,3-diazinane-2,4,6-trione, (5E)-2,6-dihydroxy-5-(1-{[4-(propan-2-yl)phenyl]amino}propylidene)pyrimidin-4(5H)-one, 5-(1-((4-isopropylphenyl)amino)propylidene)pyrimidine-2,4,6(1H,3H,5H)-trione
| Molecular Formula | C16H19N3O3 |
|---|---|
| Molecular Weight | 301.14 g/mol |
| LogP | 2.423 |
| Topological Polar Surface Area | 98.31 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 301.14264 |
| Heavy Atoms | 22 |
| Complexity | 798.6211 |
Chemical Identifiers
| CAS Number | 714946-46-0 |
|---|---|
| SMILES | CCC(=NC1=CC=C(C=C1)C(C)C)C2=C(NC(=O)NC2=O)O |
Product Overview
5-[1-(4-propan-2-ylanilino)propylidene]-1,3-diazinane-2,4,6-trione (CAS 714946-46-0), with molecular formula C16H19N3O3 and molecular weight 301.14 g/mol. IUPAC: 5-[C-ethyl-N-(4-propan-2-ylphenyl)carbonimidoyl]-6-hydroxy-1H-pyrimidine-2,4-dione.
Chemical Property Profile of 5-[1-(4-propan-2-ylanilino)propylidene]-1,3-diazinane-2,4,6-trione
Property Insights of 5-[1-(4-propan-2-ylanilino)propylidene]-1,3-diazinane-2,4,6-trione
The XLogP value of 2.423 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-[1-(4-propan-2-ylanilino)propylidene]-1,3-diazinane-2,4,6-trione. The TPSA of 98.31 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-[1-(4-propan-2-ylanilino)propylidene]-1,3-diazinane-2,4,6-trione. Following Lipinski's Rule of Five, 5-[1-(4-propan-2-ylanilino)propylidene]-1,3-diazinane-2,4,6-trione 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-[1-(4-propan-2-ylanilino)propylidene]-1,3-diazinane-2,4,6-trione?
The CAS number of 5-[1-(4-propan-2-ylanilino)propylidene]-1,3-diazinane-2,4,6-trione is 714946-46-0.
What is the molecular formula of 5-[1-(4-propan-2-ylanilino)propylidene]-1,3-diazinane-2,4,6-trione?
The molecular formula of 5-[1-(4-propan-2-ylanilino)propylidene]-1,3-diazinane-2,4,6-trione is C16H19N3O3.
What is the molecular weight of 5-[1-(4-propan-2-ylanilino)propylidene]-1,3-diazinane-2,4,6-trione?
The molecular weight of 5-[1-(4-propan-2-ylanilino)propylidene]-1,3-diazinane-2,4,6-trione is 301.14 g/mol.
Where can I buy 5-[1-(4-propan-2-ylanilino)propylidene]-1,3-diazinane-2,4,6-trione?
You can request a quote for 5-[1-(4-propan-2-ylanilino)propylidene]-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-[1-(4-propan-2-ylanilino)propylidene]-1,3-diazinane-2,4,6-trione?
Yes, KEHONG BIO provides custom synthesis services for 5-[1-(4-propan-2-ylanilino)propylidene]-1,3-diazinane-2,4,6-trione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.