![(5Z)-5-[[1-(4-bromophenyl)-2,5-dimethylpyrrol-3-yl]methylidene]-1-(4-butan-2-ylphenyl)-1,3-diazinane-2,4,6-trione structure](/static/products/799/799817-20-2.png)
(5Z)-5-[[1-(4-bromophenyl)-2,5-dimethylpyrrol-3-yl]methylidene]-1-(4-butan-2-ylphenyl)-1,3-diazinane-2,4,6-trione
TL;DR: (5Z)-5-[[1-(4-bromophenyl)-2,5-dimethylpyrrol-3-yl]methylidene]-1-(4-butan-2-ylphenyl)-1,3-diazinane-2,4,6-trione (CAS 799817-20-2) is a chemical compound with molecular formula C27H26BrN3O3 and molecular weight 519.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5Z)-5-[[1-(4-bromophenyl)-2,5-dimethylpyrrol-3-yl]methylidene]-1-(4-butan-2-ylphenyl)-1,3-diazinane-2,4,6-trione
Also Known As: (5Z)-5-[[1-(4-bromophenyl)-2,5-dimethylpyrrol-3-yl]methylidene]-1-(4-butan-2-ylphenyl)-1,3-diazinane-2,4,6-trione, (5Z)-5-{[1-(4-bromophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-1-[4-(butan-2-yl)phenyl]pyrimidine-2,4,6(1H,3H,5H)-trione, (Z)-5-((1-(4-bromophenyl)-2,5-dimethyl-1H-pyrrol-3-yl)methylene)-1-(4-(sec-butyl)phenyl)pyrimidine-2,4,6(1H,3H,5H)-trione
| Molecular Formula | C27H26BrN3O3 |
|---|---|
| Molecular Weight | 519.12 g/mol |
| LogP | 6.03654 |
| Topological Polar Surface Area | 71.41 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 519.1157 |
| Heavy Atoms | 34 |
| Complexity | 1304.1383 |
Chemical Identifiers
| CAS Number | 799817-20-2 |
|---|---|
| SMILES | CCC(C)C1=CC=C(C=C1)N2C(=O)/C(=C\C3=C(N(C(=C3)C)C4=CC=C(C=C4)Br)C)/C(=O)NC2=O |
Product Overview
(5Z)-5-[[1-(4-bromophenyl)-2,5-dimethylpyrrol-3-yl]methylidene]-1-(4-butan-2-ylphenyl)-1,3-diazinane-2,4,6-trione (CAS 799817-20-2), with molecular formula C27H26BrN3O3 and molecular weight 519.12 g/mol. IUPAC: (5Z)-5-[[1-(4-bromophenyl)-2,5-dimethylpyrrol-3-yl]methylidene]-1-(4-butan-2-ylphenyl)-1,3-diazinane-2,4,6-trione.
Chemical Property Profile of (5Z)-5-[[1-(4-bromophenyl)-2,5-dimethylpyrrol-3-yl]methylidene]-1-(4-butan-2-ylphenyl)-1,3-diazinane-2,4,6-trione
Property Insights of (5Z)-5-[[1-(4-bromophenyl)-2,5-dimethylpyrrol-3-yl]methylidene]-1-(4-butan-2-ylphenyl)-1,3-diazinane-2,4,6-trione
The XLogP value of 6.03654 indicates that (5Z)-5-[[1-(4-bromophenyl)-2,5-dimethylpyrrol-3-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 (5Z)-5-[[1-(4-bromophenyl)-2,5-dimethylpyrrol-3-yl]methylidene]-1-(4-butan-2-ylphenyl)-1,3-diazinane-2,4,6-trione. Following Lipinski's Rule of Five, (5Z)-5-[[1-(4-bromophenyl)-2,5-dimethylpyrrol-3-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), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (5Z)-5-[[1-(4-bromophenyl)-2,5-dimethylpyrrol-3-yl]methylidene]-1-(4-butan-2-ylphenyl)-1,3-diazinane-2,4,6-trione?
The CAS number of (5Z)-5-[[1-(4-bromophenyl)-2,5-dimethylpyrrol-3-yl]methylidene]-1-(4-butan-2-ylphenyl)-1,3-diazinane-2,4,6-trione is 799817-20-2.
What is the molecular formula of (5Z)-5-[[1-(4-bromophenyl)-2,5-dimethylpyrrol-3-yl]methylidene]-1-(4-butan-2-ylphenyl)-1,3-diazinane-2,4,6-trione?
The molecular formula of (5Z)-5-[[1-(4-bromophenyl)-2,5-dimethylpyrrol-3-yl]methylidene]-1-(4-butan-2-ylphenyl)-1,3-diazinane-2,4,6-trione is C27H26BrN3O3.
What is the molecular weight of (5Z)-5-[[1-(4-bromophenyl)-2,5-dimethylpyrrol-3-yl]methylidene]-1-(4-butan-2-ylphenyl)-1,3-diazinane-2,4,6-trione?
The molecular weight of (5Z)-5-[[1-(4-bromophenyl)-2,5-dimethylpyrrol-3-yl]methylidene]-1-(4-butan-2-ylphenyl)-1,3-diazinane-2,4,6-trione is 519.12 g/mol.
Where can I buy (5Z)-5-[[1-(4-bromophenyl)-2,5-dimethylpyrrol-3-yl]methylidene]-1-(4-butan-2-ylphenyl)-1,3-diazinane-2,4,6-trione?
You can request a quote for (5Z)-5-[[1-(4-bromophenyl)-2,5-dimethylpyrrol-3-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 (5Z)-5-[[1-(4-bromophenyl)-2,5-dimethylpyrrol-3-yl]methylidene]-1-(4-butan-2-ylphenyl)-1,3-diazinane-2,4,6-trione?
Yes, KEHONG BIO provides custom synthesis services for (5Z)-5-[[1-(4-bromophenyl)-2,5-dimethylpyrrol-3-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.