BE-40665D
TL;DR: BE-40665D (CAS 183241-67-0) is a chemical compound with molecular formula C22H21BrO7 and molecular weight 476.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-bromo-3,8,9-trihydroxy-4'-methoxy-2-methyl-3-propan-2-ylspiro[2H-anthracene-4,5'-furan]-1,2'-dione
Also Known As: BE-40665D, BE 40665D, J1.067.151E, 5-bromo-3,8,9-trihydroxy-4'-methoxy-2-methyl-3-propan-2-ylspiro[2H-anthracene-4,5'-furan]-1,2'-dione, 5-bromo-3,8,9-trihydroxy-4'-methoxy-2-methyl-3-propan-2-ylspiro[2H-anthracene-4,5'-uran]-1,2'-dione
| Molecular Formula | C22H21BrO7 |
|---|---|
| Molecular Weight | 476.05 g/mol |
| LogP | 3.5154 |
| Topological Polar Surface Area | 113.29 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 476.04706 |
| Heavy Atoms | 30 |
| Complexity | 1152.1157 |
Chemical Identifiers
| CAS Number | 183241-67-0 |
|---|---|
| SMILES | CC1C(=O)C2=C(C3=C(C=CC(=C3C=C2C4(C1(C(C)C)O)C(=CC(=O)O4)OC)Br)O)O |
Product Overview
BE-40665D (CAS 183241-67-0), with molecular formula C22H21BrO7 and molecular weight 476.05 g/mol. IUPAC: 5-bromo-3,8,9-trihydroxy-4'-methoxy-2-methyl-3-propan-2-ylspiro[2H-anthracene-4,5'-furan]-1,2'-dione.
Chemical Property Profile of BE-40665D
Property Insights of BE-40665D
The XLogP value of 3.5154 indicates that BE-40665D is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 113.29 Ų falls within the moderate polarity range, balancing permeability and solubility for BE-40665D. Following Lipinski's Rule of Five, BE-40665D has 3 hydrogen bond donor(s) and 7 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 BE-40665D?
The CAS number of BE-40665D is 183241-67-0.
What is the molecular formula of BE-40665D?
The molecular formula of BE-40665D is C22H21BrO7.
What is the molecular weight of BE-40665D?
The molecular weight of BE-40665D is 476.05 g/mol.
Where can I buy BE-40665D?
You can request a quote for BE-40665D directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BE-40665D?
Yes, KEHONG BIO provides custom synthesis services for BE-40665D and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.