ChemDiv1_006204
TL;DR: ChemDiv1_006204 (CAS 315237-17-3) is a chemical compound with molecular formula C22H21BrO6 and molecular weight 460.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propan-2-yl 6-bromo-2-methyl-5-(2-oxo-2-phenylmethoxyethoxy)-1-benzofuran-3-carboxylate
Also Known As: ChemDiv1_006204, propan-2-yl 5-[2-(benzyloxy)-2-oxoethoxy]-6-bromo-2-methyl-1-benzofuran-3-carboxylate, F0821-0377, isopropyl 5-(2-(benzyloxy)-2-oxoethoxy)-6-bromo-2-methylbenzofuran-3-carboxylate, isopropyl 5-[2-(benzyloxy)-2-oxoethoxy]-6-bromo-2-methyl-1-benzofuran-3-carboxylate
| Molecular Formula | C22H21BrO6 |
|---|---|
| Molecular Weight | 460.05 g/mol |
| LogP | 5.19112 |
| Topological Polar Surface Area | 74.97 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 460.05215 |
| Heavy Atoms | 29 |
| Complexity | 1022.70856 |
Chemical Identifiers
| CAS Number | 315237-17-3 |
|---|---|
| SMILES | CC1=C(C2=CC(=C(C=C2O1)Br)OCC(=O)OCC3=CC=CC=C3)C(=O)OC(C)C |
Product Overview
ChemDiv1_006204 (CAS 315237-17-3), with molecular formula C22H21BrO6 and molecular weight 460.05 g/mol. IUPAC: propan-2-yl 6-bromo-2-methyl-5-(2-oxo-2-phenylmethoxyethoxy)-1-benzofuran-3-carboxylate.
Chemical Property Profile of ChemDiv1_006204
Property Insights of ChemDiv1_006204
The XLogP value of 5.19112 indicates that ChemDiv1_006204 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.97 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_006204. Following Lipinski's Rule of Five, ChemDiv1_006204 has 0 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 ChemDiv1_006204?
The CAS number of ChemDiv1_006204 is 315237-17-3.
What is the molecular formula of ChemDiv1_006204?
The molecular formula of ChemDiv1_006204 is C22H21BrO6.
What is the molecular weight of ChemDiv1_006204?
The molecular weight of ChemDiv1_006204 is 460.05 g/mol.
Where can I buy ChemDiv1_006204?
You can request a quote for ChemDiv1_006204 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_006204?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_006204 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.