(Z)-5-((1-(2-chlorobenzyl)-1H-indol-3-yl)methylene)-1-(4-ethylphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione
TL;DR: (Z)-5-((1-(2-chlorobenzyl)-1H-indol-3-yl)methylene)-1-(4-ethylphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione (CAS 672902-13-5) is a chemical compound with molecular formula C28H22ClN3O3 and molecular weight 483.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5Z)-5-[[1-[(2-chlorophenyl)methyl]indol-3-yl]methylidene]-1-(4-ethylphenyl)-1,3-diazinane-2,4,6-trione
Also Known As: (Z)-5-((1-(2-chlorobenzyl)-1H-indol-3-yl)methylene)-1-(4-ethylphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione, (5Z)-5-[[1-[(2-chlorophenyl)methyl]indol-3-yl]methylidene]-1-(4-ethylphenyl)-1,3-diazinane-2,4,6-trione, (5Z)-5-{[1-(2-chlorobenzyl)-1H-indol-3-yl]methylidene}-1-(4-ethylphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione, (5Z)-5-{[1-(2-chlorobenzyl)-1H-indol-3-yl]methylidene}-3-(4-ethylphenyl)-6-hydroxypyrimidine-2,4(3H,5H)-dione, 5-[[1-[(2-chlorophenyl)methyl]indol-3-yl]methylidene]-1-(4-ethylphenyl)-1,3-diazinane-2,4,6-trione
| Molecular Formula | C28H22ClN3O3 |
|---|---|
| Molecular Weight | 483.13 g/mol |
| LogP | 5.5718 |
| Topological Polar Surface Area | 71.41 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 483.13498 |
| Heavy Atoms | 35 |
| Complexity | 1501.6733 |
Chemical Identifiers
| CAS Number | 672902-13-5 |
|---|---|
| SMILES | CCC1=CC=C(C=C1)N2C(=O)/C(=C\C3=CN(C4=CC=CC=C43)CC5=CC=CC=C5Cl)/C(=O)NC2=O |
Product Overview
(Z)-5-((1-(2-chlorobenzyl)-1H-indol-3-yl)methylene)-1-(4-ethylphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione (CAS 672902-13-5), with molecular formula C28H22ClN3O3 and molecular weight 483.13 g/mol. IUPAC: (5Z)-5-[[1-[(2-chlorophenyl)methyl]indol-3-yl]methylidene]-1-(4-ethylphenyl)-1,3-diazinane-2,4,6-trione.
Chemical Property Profile of (Z)-5-((1-(2-chlorobenzyl)-1H-indol-3-yl)methylene)-1-(4-ethylphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Property Insights of (Z)-5-((1-(2-chlorobenzyl)-1H-indol-3-yl)methylene)-1-(4-ethylphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione
The XLogP value of 5.5718 indicates that (Z)-5-((1-(2-chlorobenzyl)-1H-indol-3-yl)methylene)-1-(4-ethylphenyl)pyrimidine-2,4,6(1H,3H,5H)-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 (Z)-5-((1-(2-chlorobenzyl)-1H-indol-3-yl)methylene)-1-(4-ethylphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione. Following Lipinski's Rule of Five, (Z)-5-((1-(2-chlorobenzyl)-1H-indol-3-yl)methylene)-1-(4-ethylphenyl)pyrimidine-2,4,6(1H,3H,5H)-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 (Z)-5-((1-(2-chlorobenzyl)-1H-indol-3-yl)methylene)-1-(4-ethylphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione?
The CAS number of (Z)-5-((1-(2-chlorobenzyl)-1H-indol-3-yl)methylene)-1-(4-ethylphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione is 672902-13-5.
What is the molecular formula of (Z)-5-((1-(2-chlorobenzyl)-1H-indol-3-yl)methylene)-1-(4-ethylphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione?
The molecular formula of (Z)-5-((1-(2-chlorobenzyl)-1H-indol-3-yl)methylene)-1-(4-ethylphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione is C28H22ClN3O3.
What is the molecular weight of (Z)-5-((1-(2-chlorobenzyl)-1H-indol-3-yl)methylene)-1-(4-ethylphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione?
The molecular weight of (Z)-5-((1-(2-chlorobenzyl)-1H-indol-3-yl)methylene)-1-(4-ethylphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione is 483.13 g/mol.
Where can I buy (Z)-5-((1-(2-chlorobenzyl)-1H-indol-3-yl)methylene)-1-(4-ethylphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione?
You can request a quote for (Z)-5-((1-(2-chlorobenzyl)-1H-indol-3-yl)methylene)-1-(4-ethylphenyl)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 (Z)-5-((1-(2-chlorobenzyl)-1H-indol-3-yl)methylene)-1-(4-ethylphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione?
Yes, KEHONG BIO provides custom synthesis services for (Z)-5-((1-(2-chlorobenzyl)-1H-indol-3-yl)methylene)-1-(4-ethylphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.