C26H30BrFO6
TL;DR: C26H30BrFO6 (CAS 595-32-4) is a chemical compound with molecular formula C26H30BrFO6 and molecular weight 536.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-[(6R,8S,10R,13S,14S,16S)-17-acetyloxy-2-bromo-6-fluoro-10,13,16-trimethyl-3-oxo-7,8,12,14,15,16-hexahydro-6H-cyclopenta[a]phenanthren-17-yl]-2-oxoethyl] acetate
Also Known As: KST-1A6337, A,16, (6, A,16, A,17xi)-2-bromo-6-fluoro-16-methyl-3,20-dioxopregna-1,4,9(11)-triene-17,21-diyl diacetate
| Molecular Formula | C26H30BrFO6 |
|---|---|
| Molecular Weight | 536.12 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 86.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 536.121 |
| Heavy Atoms | 34 |
| Complexity | 1080.0 |
Chemical Identifiers
| CAS Number | 595-32-4 |
|---|---|
| SMILES | C[C@H]1C[C@H]2[C@@H]3C[C@H](C4=CC(=O)C(=C[C@@]4(C3=CC[C@@]2(C1(C(=O)COC(=O)C)OC(=O)C)C)C)Br)F |
| InChIKey | YUEHHSDUXVVLBM-FPVNRJEWSA-N |
Product Overview
C26H30BrFO6 (CAS 595-32-4), with molecular formula C26H30BrFO6 and molecular weight 536.12 g/mol. IUPAC: [2-[(6R,8S,10R,13S,14S,16S)-17-acetyloxy-2-bromo-6-fluoro-10,13,16-trimethyl-3-oxo-7,8,12,14,15,16-hexahydro-6H-cyclopenta[a]phenanthren-17-yl]-2-oxoethyl] acetate.
Chemical Property Profile of C26H30BrFO6
Property Insights of C26H30BrFO6
The XLogP value of 3.9 indicates that C26H30BrFO6 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.7 Ų falls within the moderate polarity range, balancing permeability and solubility for C26H30BrFO6. Following Lipinski's Rule of Five, C26H30BrFO6 has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of C26H30BrFO6?
The CAS number of C26H30BrFO6 is 595-32-4.
What is the molecular formula of C26H30BrFO6?
The molecular formula of C26H30BrFO6 is C26H30BrFO6.
What is the molecular weight of C26H30BrFO6?
The molecular weight of C26H30BrFO6 is 536.12 g/mol.
Where can I buy C26H30BrFO6?
You can request a quote for C26H30BrFO6 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C26H30BrFO6?
Yes, KEHONG BIO provides custom synthesis services for C26H30BrFO6 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.