![(5E)-1-(3-chloro-4-methylphenyl)-5-[[1-[2-(2-propan-2-ylphenoxy)ethyl]pyrrol-2-yl]methylidene]-1,3-diazinane-2,4,6-trione structure](/static/products/577/577990-84-2.png)
(5E)-1-(3-chloro-4-methylphenyl)-5-[[1-[2-(2-propan-2-ylphenoxy)ethyl]pyrrol-2-yl]methylidene]-1,3-diazinane-2,4,6-trione
TL;DR: (5E)-1-(3-chloro-4-methylphenyl)-5-[[1-[2-(2-propan-2-ylphenoxy)ethyl]pyrrol-2-yl]methylidene]-1,3-diazinane-2,4,6-trione (CAS 577990-84-2) is a chemical compound with molecular formula C27H26ClN3O4 and molecular weight 491.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5E)-1-(3-chloro-4-methylphenyl)-5-[[1-[2-(2-propan-2-ylphenoxy)ethyl]pyrrol-2-yl]methylidene]-1,3-diazinane-2,4,6-trione
Also Known As: (5E)-1-(3-chloro-4-methylphenyl)-5-[[1-[2-(2-propan-2-ylphenoxy)ethyl]pyrrol-2-yl]methylidene]-1,3-diazinane-2,4,6-trione, (5E)-3-(3-chloro-4-methylphenyl)-6-hydroxy-5-[(1-{2-[2-(propan-2-yl)phenoxy]ethyl}-1H-pyrrol-2-yl)methylidene]pyrimidine-2,4(3H,5H)-dione, (E)-1-(3-chloro-4-methylphenyl)-5-((1-(2-(2-isopropylphenoxy)ethyl)-1H-pyrrol-2-yl)methylene)pyrimidine-2,4,6(1H,3H,5H)-trione
| Molecular Formula | C27H26ClN3O4 |
|---|---|
| Molecular Weight | 491.16 g/mol |
| LogP | 5.31872 |
| Topological Polar Surface Area | 80.64 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 491.1612 |
| Heavy Atoms | 35 |
| Complexity | 1325.4655 |
Chemical Identifiers
| CAS Number | 577990-84-2 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)N2C(=O)/C(=C/C3=CC=CN3CCOC4=CC=CC=C4C(C)C)/C(=O)NC2=O)Cl |
Product Overview
(5E)-1-(3-chloro-4-methylphenyl)-5-[[1-[2-(2-propan-2-ylphenoxy)ethyl]pyrrol-2-yl]methylidene]-1,3-diazinane-2,4,6-trione (CAS 577990-84-2), with molecular formula C27H26ClN3O4 and molecular weight 491.16 g/mol. IUPAC: (5E)-1-(3-chloro-4-methylphenyl)-5-[[1-[2-(2-propan-2-ylphenoxy)ethyl]pyrrol-2-yl]methylidene]-1,3-diazinane-2,4,6-trione.
Chemical Property Profile of (5E)-1-(3-chloro-4-methylphenyl)-5-[[1-[2-(2-propan-2-ylphenoxy)ethyl]pyrrol-2-yl]methylidene]-1,3-diazinane-2,4,6-trione
Property Insights of (5E)-1-(3-chloro-4-methylphenyl)-5-[[1-[2-(2-propan-2-ylphenoxy)ethyl]pyrrol-2-yl]methylidene]-1,3-diazinane-2,4,6-trione
The XLogP value of 5.31872 indicates that (5E)-1-(3-chloro-4-methylphenyl)-5-[[1-[2-(2-propan-2-ylphenoxy)ethyl]pyrrol-2-yl]methylidene]-1,3-diazinane-2,4,6-trione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.64 Ų falls within the moderate polarity range, balancing permeability and solubility for (5E)-1-(3-chloro-4-methylphenyl)-5-[[1-[2-(2-propan-2-ylphenoxy)ethyl]pyrrol-2-yl]methylidene]-1,3-diazinane-2,4,6-trione. Following Lipinski's Rule of Five, (5E)-1-(3-chloro-4-methylphenyl)-5-[[1-[2-(2-propan-2-ylphenoxy)ethyl]pyrrol-2-yl]methylidene]-1,3-diazinane-2,4,6-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 (5E)-1-(3-chloro-4-methylphenyl)-5-[[1-[2-(2-propan-2-ylphenoxy)ethyl]pyrrol-2-yl]methylidene]-1,3-diazinane-2,4,6-trione?
The CAS number of (5E)-1-(3-chloro-4-methylphenyl)-5-[[1-[2-(2-propan-2-ylphenoxy)ethyl]pyrrol-2-yl]methylidene]-1,3-diazinane-2,4,6-trione is 577990-84-2.
What is the molecular formula of (5E)-1-(3-chloro-4-methylphenyl)-5-[[1-[2-(2-propan-2-ylphenoxy)ethyl]pyrrol-2-yl]methylidene]-1,3-diazinane-2,4,6-trione?
The molecular formula of (5E)-1-(3-chloro-4-methylphenyl)-5-[[1-[2-(2-propan-2-ylphenoxy)ethyl]pyrrol-2-yl]methylidene]-1,3-diazinane-2,4,6-trione is C27H26ClN3O4.
What is the molecular weight of (5E)-1-(3-chloro-4-methylphenyl)-5-[[1-[2-(2-propan-2-ylphenoxy)ethyl]pyrrol-2-yl]methylidene]-1,3-diazinane-2,4,6-trione?
The molecular weight of (5E)-1-(3-chloro-4-methylphenyl)-5-[[1-[2-(2-propan-2-ylphenoxy)ethyl]pyrrol-2-yl]methylidene]-1,3-diazinane-2,4,6-trione is 491.16 g/mol.
Where can I buy (5E)-1-(3-chloro-4-methylphenyl)-5-[[1-[2-(2-propan-2-ylphenoxy)ethyl]pyrrol-2-yl]methylidene]-1,3-diazinane-2,4,6-trione?
You can request a quote for (5E)-1-(3-chloro-4-methylphenyl)-5-[[1-[2-(2-propan-2-ylphenoxy)ethyl]pyrrol-2-yl]methylidene]-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 (5E)-1-(3-chloro-4-methylphenyl)-5-[[1-[2-(2-propan-2-ylphenoxy)ethyl]pyrrol-2-yl]methylidene]-1,3-diazinane-2,4,6-trione?
Yes, KEHONG BIO provides custom synthesis services for (5E)-1-(3-chloro-4-methylphenyl)-5-[[1-[2-(2-propan-2-ylphenoxy)ethyl]pyrrol-2-yl]methylidene]-1,3-diazinane-2,4,6-trione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.