A2744/0116568
TL;DR: A2744/0116568 (CAS 384359-10-8) is a chemical compound with molecular formula C21H20Br2O3 and molecular weight 477.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(4-bromophenyl)-3-[(4-bromophenyl)methyl]-3,5,5-trimethyloxane-2,4-dione
Also Known As: A2744/0116568, 3-(4-bromobenzyl)-6-(4-bromophenyl)-3,5,5-trimethyldihydro-2H-pyran-2,4(3H)-dione, 6-(4-bromophenyl)-3-[(4-bromophenyl)methyl]-3,5,5-trimethyloxane-2,4-dione
| Molecular Formula | C21H20Br2O3 |
|---|---|
| Molecular Weight | 477.98 g/mol |
| LogP | 5.6538 |
| Topological Polar Surface Area | 43.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 477.9779 |
| Heavy Atoms | 26 |
| Complexity | 840.5648 |
Chemical Identifiers
| CAS Number | 384359-10-8 |
|---|---|
| SMILES | CC1(C(OC(=O)C(C1=O)(C)CC2=CC=C(C=C2)Br)C3=CC=C(C=C3)Br)C |
Product Overview
A2744/0116568 (CAS 384359-10-8), with molecular formula C21H20Br2O3 and molecular weight 477.98 g/mol. IUPAC: 6-(4-bromophenyl)-3-[(4-bromophenyl)methyl]-3,5,5-trimethyloxane-2,4-dione.
Chemical Property Profile of A2744/0116568
Property Insights of A2744/0116568
The XLogP value of 5.6538 indicates that A2744/0116568 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.37 Ų, A2744/0116568 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, A2744/0116568 has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of A2744/0116568?
The CAS number of A2744/0116568 is 384359-10-8.
What is the molecular formula of A2744/0116568?
The molecular formula of A2744/0116568 is C21H20Br2O3.
What is the molecular weight of A2744/0116568?
The molecular weight of A2744/0116568 is 477.98 g/mol.
Where can I buy A2744/0116568?
You can request a quote for A2744/0116568 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A2744/0116568?
Yes, KEHONG BIO provides custom synthesis services for A2744/0116568 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.