KST-1B9471
TL;DR: KST-1B9471 (CAS 96429-66-2) is a chemical compound with molecular formula C28H18Br2 and molecular weight 511.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,9-dibromoheptacyclo[8.6.6.62,9.03,8.011,16.017,22.023,28]octacosa-3,5,7,11,13,15,17,19,21,23,25,27-dodecaene
Also Known As: KST-1B9471, J2.102.978E, J2.490.961A, 1,9-dibromoheptacyclo[8.6.6.62,9.03,8.011,16.017,22.023,28]octacosa-3,5,7,11,13,15,17,19,21,23,25,27-dodecaene(non-preferred name), 9,10-Dihydro-9beta,10beta-(9-bromo-9,10-dihydroanthracene-9alpha,10alpha-diyl)-10-bromoanthracene
| Molecular Formula | C28H18Br2 |
|---|---|
| Molecular Weight | 511.98 g/mol |
| LogP | 7.1 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 511.97754 |
| Heavy Atoms | 30 |
| Complexity | 580.0 |
Chemical Identifiers
| CAS Number | 96429-66-2 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C3C4=CC=CC=C4C2(C5C6=CC=CC=C6C3(C7=CC=CC=C57)Br)Br |
| InChIKey | MJGZEHWEUBTBHE-UHFFFAOYSA-N |
Product Overview
KST-1B9471 (CAS 96429-66-2), with molecular formula C28H18Br2 and molecular weight 511.98 g/mol. IUPAC: 1,9-dibromoheptacyclo[8.6.6.62,9.03,8.011,16.017,22.023,28]octacosa-3,5,7,11,13,15,17,19,21,23,25,27-dodecaene.
Chemical Property Profile of KST-1B9471
Property Insights of KST-1B9471
The XLogP value of 7.1 indicates that KST-1B9471 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, KST-1B9471 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, KST-1B9471 has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of KST-1B9471?
The CAS number of KST-1B9471 is 96429-66-2.
What is the molecular formula of KST-1B9471?
The molecular formula of KST-1B9471 is C28H18Br2.
What is the molecular weight of KST-1B9471?
The molecular weight of KST-1B9471 is 511.98 g/mol.
Where can I buy KST-1B9471?
You can request a quote for KST-1B9471 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for KST-1B9471?
Yes, KEHONG BIO provides custom synthesis services for KST-1B9471 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.