ChemDiv1_010454
TL;DR: ChemDiv1_010454 (CAS 428487-49-4) is a chemical compound with molecular formula C20H13BrClN3O3 and molecular weight 456.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-bromophenoxy)-N-[2-chloro-5-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]acetamide
Also Known As: ChemDiv1_010454, AN-465/15402063, 2-(4-bromophenoxy)-N-[2-chloro-5-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]acetamide, 2-(4-bromophenoxy)-N-(2-chloro-5-[1,3]oxazolo[4,5-b]pyridin-2-ylphenyl)acetamide, 2-(4-BROMOPHENOXY)-N-(2-CHLORO-5-{[1,3]OXAZOLO[4,5-B]PYRIDIN-2-YL}PHENYL)ACETAMIDE
| Molecular Formula | C20H13BrClN3O3 |
|---|---|
| Molecular Weight | 456.98 g/mol |
| LogP | 5.3232 |
| Topological Polar Surface Area | 77.25 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 456.98288 |
| Heavy Atoms | 28 |
| Complexity | 1112.1171 |
Chemical Identifiers
| CAS Number | 428487-49-4 |
|---|---|
| SMILES | C1=CC2=C(N=C1)N=C(O2)C3=CC(=C(C=C3)Cl)NC(=O)COC4=CC=C(C=C4)Br |
Product Overview
ChemDiv1_010454 (CAS 428487-49-4), with molecular formula C20H13BrClN3O3 and molecular weight 456.98 g/mol. IUPAC: 2-(4-bromophenoxy)-N-[2-chloro-5-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]acetamide.
Chemical Property Profile of ChemDiv1_010454
Property Insights of ChemDiv1_010454
The XLogP value of 5.3232 indicates that ChemDiv1_010454 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.25 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_010454. Following Lipinski's Rule of Five, ChemDiv1_010454 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ChemDiv1_010454?
The CAS number of ChemDiv1_010454 is 428487-49-4.
What is the molecular formula of ChemDiv1_010454?
The molecular formula of ChemDiv1_010454 is C20H13BrClN3O3.
What is the molecular weight of ChemDiv1_010454?
The molecular weight of ChemDiv1_010454 is 456.98 g/mol.
Where can I buy ChemDiv1_010454?
You can request a quote for ChemDiv1_010454 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_010454?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_010454 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.