![5-[(1-benzylpyrrol-2-yl)methylidene]-1-(4-butan-2-ylphenyl)-1,3-diazinane-2,4,6-trione structure](/static/products/799/799799-79-4.png)
5-[(1-benzylpyrrol-2-yl)methylidene]-1-(4-butan-2-ylphenyl)-1,3-diazinane-2,4,6-trione
TL;DR: 5-[(1-benzylpyrrol-2-yl)methylidene]-1-(4-butan-2-ylphenyl)-1,3-diazinane-2,4,6-trione (CAS 799799-79-4) is a chemical compound with molecular formula C26H25N3O3 and molecular weight 427.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5Z)-5-[(1-benzylpyrrol-2-yl)methylidene]-1-(4-butan-2-ylphenyl)-1,3-diazinane-2,4,6-trione
Also Known As: 5-[(1-benzylpyrrol-2-yl)methylidene]-1-(4-butan-2-ylphenyl)-1,3-diazinane-2,4,6-trione, (5Z)-5-[(1-benzylpyrrol-2-yl)methylidene]-1-(4-butan-2-ylphenyl)-1,3-diazinane-2,4,6-trione, (Z)-5-((1-benzyl-1H-pyrrol-2-yl)methylene)-1-(4-(sec-butyl)phenyl)pyrimidine-2,4,6(1H,3H,5H)-trione
| Molecular Formula | C26H25N3O3 |
|---|---|
| Molecular Weight | 427.19 g/mol |
| LogP | 4.7163 |
| Topological Polar Surface Area | 71.41 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 427.1896 |
| Heavy Atoms | 32 |
| Complexity | 1176.5409 |
Chemical Identifiers
| CAS Number | 799799-79-4 |
|---|---|
| SMILES | CCC(C)C1=CC=C(C=C1)N2C(=O)/C(=C\C3=CC=CN3CC4=CC=CC=C4)/C(=O)NC2=O |
Product Overview
5-[(1-benzylpyrrol-2-yl)methylidene]-1-(4-butan-2-ylphenyl)-1,3-diazinane-2,4,6-trione (CAS 799799-79-4), with molecular formula C26H25N3O3 and molecular weight 427.19 g/mol. IUPAC: (5Z)-5-[(1-benzylpyrrol-2-yl)methylidene]-1-(4-butan-2-ylphenyl)-1,3-diazinane-2,4,6-trione.
Chemical Property Profile of 5-[(1-benzylpyrrol-2-yl)methylidene]-1-(4-butan-2-ylphenyl)-1,3-diazinane-2,4,6-trione
Property Insights of 5-[(1-benzylpyrrol-2-yl)methylidene]-1-(4-butan-2-ylphenyl)-1,3-diazinane-2,4,6-trione
The XLogP value of 4.7163 indicates that 5-[(1-benzylpyrrol-2-yl)methylidene]-1-(4-butan-2-ylphenyl)-1,3-diazinane-2,4,6-trione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.41 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-[(1-benzylpyrrol-2-yl)methylidene]-1-(4-butan-2-ylphenyl)-1,3-diazinane-2,4,6-trione. Following Lipinski's Rule of Five, 5-[(1-benzylpyrrol-2-yl)methylidene]-1-(4-butan-2-ylphenyl)-1,3-diazinane-2,4,6-trione has 1 hydrogen bond donor(s) and 3 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-benzylpyrrol-2-yl)methylidene]-1-(4-butan-2-ylphenyl)-1,3-diazinane-2,4,6-trione?
The CAS number of 5-[(1-benzylpyrrol-2-yl)methylidene]-1-(4-butan-2-ylphenyl)-1,3-diazinane-2,4,6-trione is 799799-79-4.
What is the molecular formula of 5-[(1-benzylpyrrol-2-yl)methylidene]-1-(4-butan-2-ylphenyl)-1,3-diazinane-2,4,6-trione?
The molecular formula of 5-[(1-benzylpyrrol-2-yl)methylidene]-1-(4-butan-2-ylphenyl)-1,3-diazinane-2,4,6-trione is C26H25N3O3.
What is the molecular weight of 5-[(1-benzylpyrrol-2-yl)methylidene]-1-(4-butan-2-ylphenyl)-1,3-diazinane-2,4,6-trione?
The molecular weight of 5-[(1-benzylpyrrol-2-yl)methylidene]-1-(4-butan-2-ylphenyl)-1,3-diazinane-2,4,6-trione is 427.19 g/mol.
Where can I buy 5-[(1-benzylpyrrol-2-yl)methylidene]-1-(4-butan-2-ylphenyl)-1,3-diazinane-2,4,6-trione?
You can request a quote for 5-[(1-benzylpyrrol-2-yl)methylidene]-1-(4-butan-2-ylphenyl)-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-benzylpyrrol-2-yl)methylidene]-1-(4-butan-2-ylphenyl)-1,3-diazinane-2,4,6-trione?
Yes, KEHONG BIO provides custom synthesis services for 5-[(1-benzylpyrrol-2-yl)methylidene]-1-(4-butan-2-ylphenyl)-1,3-diazinane-2,4,6-trione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.