KST-1A7643
TL;DR: KST-1A7643 (CAS 6966-78-5) is a chemical compound with molecular formula C24H33ClO5 and molecular weight 436.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1S,2S,4S,8S,9S,11S,12S,13R)-8-(2-chloroacetyl)-11-hydroxy-6,6,9,13-tetramethyl-5,7-dioxapentacyclo[10.8.0.02,9.04,8.013,18]icos-17-en-16-one
Also Known As: KST-1A7643, SQ 20811, SQ 20,811, (4ar,4bs,5s,6as,6bs,9as,10as,10bs)-6b-(chloroacetyl)-5-hydroxy-4a,6a,8,8-tetramethyl-3,4,4a,4b,5,6,6a,6b,9a,10,10a,10b,11,12-tetradecahydro-2h-naphtho[2',1':4,5]indeno[1,2-d][1,3]dioxol-2-one, (1S,2S,4S,8S,9S,11S,12S,13R)-8-(2-Chloroacetyl)-11-hydroxy-6,6,9,13-tetramethyl-5,7-dioxapentacyclo[10.8.0.02,9.04,8.013,18]icos-17-en-16-one
| Molecular Formula | C24H33ClO5 |
|---|---|
| Molecular Weight | 436.20 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 72.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 436.20166 |
| Heavy Atoms | 30 |
| Complexity | 835.0 |
Chemical Identifiers
| CAS Number | 6966-78-5 |
|---|---|
| SMILES | C[C@]12CCC(=O)C=C1CC[C@@H]3[C@@H]2[C@H](C[C@]4([C@H]3C[C@H]5[C@]4(OC(O5)(C)C)C(=O)CCl)C)O |
| InChIKey | FXFIRGYQADSTIQ-JGHJVBRBSA-N |
Product Overview
KST-1A7643 (CAS 6966-78-5), with molecular formula C24H33ClO5 and molecular weight 436.20 g/mol. IUPAC: (1S,2S,4S,8S,9S,11S,12S,13R)-8-(2-chloroacetyl)-11-hydroxy-6,6,9,13-tetramethyl-5,7-dioxapentacyclo[10.8.0.02,9.04,8.013,18]icos-17-en-16-one.
Chemical Property Profile of KST-1A7643
Property Insights of KST-1A7643
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for KST-1A7643. The TPSA of 72.8 Ų falls within the moderate polarity range, balancing permeability and solubility for KST-1A7643. Following Lipinski's Rule of Five, KST-1A7643 has 1 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 KST-1A7643?
The CAS number of KST-1A7643 is 6966-78-5.
What is the molecular formula of KST-1A7643?
The molecular formula of KST-1A7643 is C24H33ClO5.
What is the molecular weight of KST-1A7643?
The molecular weight of KST-1A7643 is 436.20 g/mol.
Where can I buy KST-1A7643?
You can request a quote for KST-1A7643 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for KST-1A7643?
Yes, KEHONG BIO provides custom synthesis services for KST-1A7643 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.