ChemDiv1_006336
TL;DR: ChemDiv1_006336 (CAS 315237-23-1) is a chemical compound with molecular formula C19H23BrO6 and molecular weight 426.07 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-[(2-methylpropan-2-yl)oxy]-2-oxoethoxy]-1-benzofuran-3-carboxylate
Also Known As: ChemDiv1_006336, F0821-0395, isopropyl 6-bromo-5-(2-(tert-butoxy)-2-oxoethoxy)-2-methylbenzofuran-3-carboxylate, propan-2-yl 6-bromo-5-[2-(tert-butoxy)-2-oxoethoxy]-2-methyl-1-benzofuran-3-carboxylate, propan-2-yl 6-bromo-2-methyl-5-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethoxy]-1-benzofuran-3-carboxylate
| Molecular Formula | C19H23BrO6 |
|---|---|
| Molecular Weight | 426.07 g/mol |
| LogP | 4.78942 |
| Topological Polar Surface Area | 74.97 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 426.0678 |
| Heavy Atoms | 26 |
| Complexity | 828.6474 |
Chemical Identifiers
| CAS Number | 315237-23-1 |
|---|---|
| SMILES | CC1=C(C2=CC(=C(C=C2O1)Br)OCC(=O)OC(C)(C)C)C(=O)OC(C)C |
Product Overview
ChemDiv1_006336 (CAS 315237-23-1), with molecular formula C19H23BrO6 and molecular weight 426.07 g/mol. IUPAC: propan-2-yl 6-bromo-2-methyl-5-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethoxy]-1-benzofuran-3-carboxylate.
Chemical Property Profile of ChemDiv1_006336
Property Insights of ChemDiv1_006336
The XLogP value of 4.78942 indicates that ChemDiv1_006336 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_006336. Following Lipinski's Rule of Five, ChemDiv1_006336 has 0 hydrogen bond donor(s) and 6 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 ChemDiv1_006336?
The CAS number of ChemDiv1_006336 is 315237-23-1.
What is the molecular formula of ChemDiv1_006336?
The molecular formula of ChemDiv1_006336 is C19H23BrO6.
What is the molecular weight of ChemDiv1_006336?
The molecular weight of ChemDiv1_006336 is 426.07 g/mol.
Where can I buy ChemDiv1_006336?
You can request a quote for ChemDiv1_006336 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_006336?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_006336 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.