BIM-0044246.P001
TL;DR: BIM-0044246.P001 (CAS 6068-98-0) is a chemical compound with molecular formula C19H14BrClN2O4 and molecular weight 447.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5E)-5-[(3-bromo-4-ethoxyphenyl)methylidene]-1-(4-chlorophenyl)-1,3-diazinane-2,4,6-trione
Also Known As: BIM-0044246.P001, (5E)-5-(3-bromo-4-ethoxybenzylidene)-1-(4-chlorophenyl)pyrimidine-2,4,6(1H,3H,5H)-trione, (5E)-5-[(3-bromo-4-ethoxyphenyl)methylidene]-1-(4-chlorophenyl)-1,3-diazinane-2,4,6-trione, 5-[(3-bromo-4-ethoxyphenyl)methylidene]-1-(4-chlorophenyl)-1,3-diazinane-2,4,6-trione, (5E)-5-[(3-bromo-4-ethoxy-phenyl)methylidene]-1-(4-chlorophenyl)-1,3-diazinane-2,4,6-trione
| Molecular Formula | C19H14BrClN2O4 |
|---|---|
| Molecular Weight | 447.98 g/mol |
| LogP | 4.1676 |
| Topological Polar Surface Area | 75.71 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 447.98254 |
| Heavy Atoms | 27 |
| Complexity | 956.68207 |
Chemical Identifiers
| CAS Number | 6068-98-0 |
|---|---|
| SMILES | CCOC1=C(C=C(C=C1)/C=C/2\C(=O)NC(=O)N(C2=O)C3=CC=C(C=C3)Cl)Br |
Product Overview
BIM-0044246.P001 (CAS 6068-98-0), with molecular formula C19H14BrClN2O4 and molecular weight 447.98 g/mol. IUPAC: (5E)-5-[(3-bromo-4-ethoxyphenyl)methylidene]-1-(4-chlorophenyl)-1,3-diazinane-2,4,6-trione.
Chemical Property Profile of BIM-0044246.P001
Property Insights of BIM-0044246.P001
The XLogP value of 4.1676 indicates that BIM-0044246.P001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.71 Ų falls within the moderate polarity range, balancing permeability and solubility for BIM-0044246.P001. Following Lipinski's Rule of Five, BIM-0044246.P001 has 1 hydrogen bond donor(s) and 4 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 BIM-0044246.P001?
The CAS number of BIM-0044246.P001 is 6068-98-0.
What is the molecular formula of BIM-0044246.P001?
The molecular formula of BIM-0044246.P001 is C19H14BrClN2O4.
What is the molecular weight of BIM-0044246.P001?
The molecular weight of BIM-0044246.P001 is 447.98 g/mol.
Where can I buy BIM-0044246.P001?
You can request a quote for BIM-0044246.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BIM-0044246.P001?
Yes, KEHONG BIO provides custom synthesis services for BIM-0044246.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.