CBKinase1_002052
TL;DR: CBKinase1_002052 (CAS 308297-53-2) is a chemical compound with molecular formula C19H14BrFO5 and molecular weight 420.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 6-bromo-5-[2-(4-fluorophenyl)-2-oxoethoxy]-2-methyl-1-benzofuran-3-carboxylate
Also Known As: CBKinase1_002052, CBKinase1_014452, methyl 6-bromo-5-[2-(4-fluorophenyl)-2-oxoethoxy]-2-methyl-1-benzofuran-3-carboxylate, AE-641/15338356, BRD-K40514257-001-01-5
| Molecular Formula | C19H14BrFO5 |
|---|---|
| Molecular Weight | 420.00 g/mol |
| LogP | 4.69112 |
| Topological Polar Surface Area | 65.74 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 420.00085 |
| Heavy Atoms | 26 |
| Complexity | 991.3273 |
Chemical Identifiers
| CAS Number | 308297-53-2 |
|---|---|
| SMILES | CC1=C(C2=CC(=C(C=C2O1)Br)OCC(=O)C3=CC=C(C=C3)F)C(=O)OC |
Product Overview
CBKinase1_002052 (CAS 308297-53-2), with molecular formula C19H14BrFO5 and molecular weight 420.00 g/mol. IUPAC: methyl 6-bromo-5-[2-(4-fluorophenyl)-2-oxoethoxy]-2-methyl-1-benzofuran-3-carboxylate.
Chemical Property Profile of CBKinase1_002052
Property Insights of CBKinase1_002052
The XLogP value of 4.69112 indicates that CBKinase1_002052 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.74 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_002052. Following Lipinski's Rule of Five, CBKinase1_002052 has 0 hydrogen bond donor(s) and 5 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 CBKinase1_002052?
The CAS number of CBKinase1_002052 is 308297-53-2.
What is the molecular formula of CBKinase1_002052?
The molecular formula of CBKinase1_002052 is C19H14BrFO5.
What is the molecular weight of CBKinase1_002052?
The molecular weight of CBKinase1_002052 is 420.00 g/mol.
Where can I buy CBKinase1_002052?
You can request a quote for CBKinase1_002052 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_002052?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_002052 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.