(E)-5-((1-(4-bromonaphthalen-1-yl)-2,5-dimethyl-1H-pyrrol-3-yl)methylene)-1-(furan-2-ylmethyl)pyrimidine-2,4,6(1H,3H,5H)-trione
TL;DR: (E)-5-((1-(4-bromonaphthalen-1-yl)-2,5-dimethyl-1H-pyrrol-3-yl)methylene)-1-(furan-2-ylmethyl)pyrimidine-2,4,6(1H,3H,5H)-trione (CAS 345337-95-3) is a chemical compound with molecular formula C26H20BrN3O4 and molecular weight 517.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5E)-5-[[1-(4-bromonaphthalen-1-yl)-2,5-dimethylpyrrol-3-yl]methylidene]-1-(furan-2-ylmethyl)-1,3-diazinane-2,4,6-trione
Also Known As: (E)-5-((1-(4-bromonaphthalen-1-yl)-2,5-dimethyl-1H-pyrrol-3-yl)methylene)-1-(furan-2-ylmethyl)pyrimidine-2,4,6(1H,3H,5H)-trione, (5E)-5-[[1-(4-bromonaphthalen-1-yl)-2,5-dimethylpyrrol-3-yl]methylidene]-1-(furan-2-ylmethyl)-1,3-diazinane-2,4,6-trione, (5E)-5-{[1-(4-bromonaphthalen-1-yl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-3-(furan-2-ylmethyl)-6-hydroxypyrimidine-2,4(3H,5H)-dione, 5-{[1-(4-bromonaphthyl)-2,5-dimethylpyrrol-3-yl]methylene}-1-(2-furylmethyl)-1 ,3-dihydropyrimidine-2,4,6-trione
| Molecular Formula | C26H20BrN3O4 |
|---|---|
| Molecular Weight | 517.06 g/mol |
| LogP | 5.26484 |
| Topological Polar Surface Area | 84.55 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 517.0637 |
| Heavy Atoms | 34 |
| Complexity | 1498.0209 |
Chemical Identifiers
| CAS Number | 345337-95-3 |
|---|---|
| SMILES | CC1=CC(=C(N1C2=CC=C(C3=CC=CC=C32)Br)C)/C=C/4\C(=O)NC(=O)N(C4=O)CC5=CC=CO5 |
Product Overview
(E)-5-((1-(4-bromonaphthalen-1-yl)-2,5-dimethyl-1H-pyrrol-3-yl)methylene)-1-(furan-2-ylmethyl)pyrimidine-2,4,6(1H,3H,5H)-trione (CAS 345337-95-3), with molecular formula C26H20BrN3O4 and molecular weight 517.06 g/mol. IUPAC: (5E)-5-[[1-(4-bromonaphthalen-1-yl)-2,5-dimethylpyrrol-3-yl]methylidene]-1-(furan-2-ylmethyl)-1,3-diazinane-2,4,6-trione.
Chemical Property Profile of (E)-5-((1-(4-bromonaphthalen-1-yl)-2,5-dimethyl-1H-pyrrol-3-yl)methylene)-1-(furan-2-ylmethyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Property Insights of (E)-5-((1-(4-bromonaphthalen-1-yl)-2,5-dimethyl-1H-pyrrol-3-yl)methylene)-1-(furan-2-ylmethyl)pyrimidine-2,4,6(1H,3H,5H)-trione
The XLogP value of 5.26484 indicates that (E)-5-((1-(4-bromonaphthalen-1-yl)-2,5-dimethyl-1H-pyrrol-3-yl)methylene)-1-(furan-2-ylmethyl)pyrimidine-2,4,6(1H,3H,5H)-trione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.55 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-5-((1-(4-bromonaphthalen-1-yl)-2,5-dimethyl-1H-pyrrol-3-yl)methylene)-1-(furan-2-ylmethyl)pyrimidine-2,4,6(1H,3H,5H)-trione. Following Lipinski's Rule of Five, (E)-5-((1-(4-bromonaphthalen-1-yl)-2,5-dimethyl-1H-pyrrol-3-yl)methylene)-1-(furan-2-ylmethyl)pyrimidine-2,4,6(1H,3H,5H)-trione has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (E)-5-((1-(4-bromonaphthalen-1-yl)-2,5-dimethyl-1H-pyrrol-3-yl)methylene)-1-(furan-2-ylmethyl)pyrimidine-2,4,6(1H,3H,5H)-trione?
The CAS number of (E)-5-((1-(4-bromonaphthalen-1-yl)-2,5-dimethyl-1H-pyrrol-3-yl)methylene)-1-(furan-2-ylmethyl)pyrimidine-2,4,6(1H,3H,5H)-trione is 345337-95-3.
What is the molecular formula of (E)-5-((1-(4-bromonaphthalen-1-yl)-2,5-dimethyl-1H-pyrrol-3-yl)methylene)-1-(furan-2-ylmethyl)pyrimidine-2,4,6(1H,3H,5H)-trione?
The molecular formula of (E)-5-((1-(4-bromonaphthalen-1-yl)-2,5-dimethyl-1H-pyrrol-3-yl)methylene)-1-(furan-2-ylmethyl)pyrimidine-2,4,6(1H,3H,5H)-trione is C26H20BrN3O4.
What is the molecular weight of (E)-5-((1-(4-bromonaphthalen-1-yl)-2,5-dimethyl-1H-pyrrol-3-yl)methylene)-1-(furan-2-ylmethyl)pyrimidine-2,4,6(1H,3H,5H)-trione?
The molecular weight of (E)-5-((1-(4-bromonaphthalen-1-yl)-2,5-dimethyl-1H-pyrrol-3-yl)methylene)-1-(furan-2-ylmethyl)pyrimidine-2,4,6(1H,3H,5H)-trione is 517.06 g/mol.
Where can I buy (E)-5-((1-(4-bromonaphthalen-1-yl)-2,5-dimethyl-1H-pyrrol-3-yl)methylene)-1-(furan-2-ylmethyl)pyrimidine-2,4,6(1H,3H,5H)-trione?
You can request a quote for (E)-5-((1-(4-bromonaphthalen-1-yl)-2,5-dimethyl-1H-pyrrol-3-yl)methylene)-1-(furan-2-ylmethyl)pyrimidine-2,4,6(1H,3H,5H)-trione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-5-((1-(4-bromonaphthalen-1-yl)-2,5-dimethyl-1H-pyrrol-3-yl)methylene)-1-(furan-2-ylmethyl)pyrimidine-2,4,6(1H,3H,5H)-trione?
Yes, KEHONG BIO provides custom synthesis services for (E)-5-((1-(4-bromonaphthalen-1-yl)-2,5-dimethyl-1H-pyrrol-3-yl)methylene)-1-(furan-2-ylmethyl)pyrimidine-2,4,6(1H,3H,5H)-trione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.