CAS 618080-50-5 - C25H21BrN2O5
TL;DR: CAS 618080-50-5 - C25H21BrN2O5 (CAS 618080-50-5) is a chemical compound with molecular formula C25H21BrN2O5 and molecular weight 508.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4E)-5-(4-bromophenyl)-4-[(3,4-dimethoxyphenyl)-hydroxymethylidene]-1-(pyridin-3-ylmethyl)pyrrolidine-2,3-dione
Also Known As: 5-(4-Bromophenyl)-4-(3,4-dimethoxybenzoyl)-3-hydroxy-1-(pyridin-3-ylmethyl)-1H-pyrrol-2(5H)-one
| Molecular Formula | C25H21BrN2O5 |
|---|---|
| Molecular Weight | 508.06 g/mol |
| LogP | 4.4832 |
| Topological Polar Surface Area | 88.96 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 508.0634 |
| Heavy Atoms | 33 |
| Complexity | 1225.3044 |
Chemical Identifiers
| CAS Number | 618080-50-5 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)/C(=C\2/C(N(C(=O)C2=O)CC3=CN=CC=C3)C4=CC=C(C=C4)Br)/O)OC |
Product Overview
CAS 618080-50-5 - C25H21BrN2O5 (CAS 618080-50-5), with molecular formula C25H21BrN2O5 and molecular weight 508.06 g/mol. IUPAC: (4E)-5-(4-bromophenyl)-4-[(3,4-dimethoxyphenyl)-hydroxymethylidene]-1-(pyridin-3-ylmethyl)pyrrolidine-2,3-dione.
Chemical Property Profile of CAS 618080-50-5 - C25H21BrN2O5
Property Insights of CAS 618080-50-5 - C25H21BrN2O5
The XLogP value of 4.4832 indicates that CAS 618080-50-5 - C25H21BrN2O5 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.96 Ų falls within the moderate polarity range, balancing permeability and solubility for CAS 618080-50-5 - C25H21BrN2O5. Following Lipinski's Rule of Five, CAS 618080-50-5 - C25H21BrN2O5 has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of CAS 618080-50-5 - C25H21BrN2O5?
The CAS number of CAS 618080-50-5 - C25H21BrN2O5 is 618080-50-5.
What is the molecular formula of CAS 618080-50-5 - C25H21BrN2O5?
The molecular formula of CAS 618080-50-5 - C25H21BrN2O5 is C25H21BrN2O5.
What is the molecular weight of CAS 618080-50-5 - C25H21BrN2O5?
The molecular weight of CAS 618080-50-5 - C25H21BrN2O5 is 508.06 g/mol.
Where can I buy CAS 618080-50-5 - C25H21BrN2O5?
You can request a quote for CAS 618080-50-5 - C25H21BrN2O5 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CAS 618080-50-5 - C25H21BrN2O5?
Yes, KEHONG BIO provides custom synthesis services for CAS 618080-50-5 - C25H21BrN2O5 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.