RefChem:268587
TL;DR: RefChem:268587 (CAS 32545-64-5) is a chemical compound with molecular formula C40H64Cl2N2O6 and molecular weight 738.41 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(1R)-1-[[(2R,3R,11bS)-3-ethyl-9,10-dimethoxy-2,3,4,6,7,11b-hexahydro-1H-benzo[a]quinolizin-2-yl]methyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]-3-(2-ethylhexoxy)propan-2-ol;dihydrochloride
Also Known As: KST-1B3088, Emetine, 2'-(3-((2-ethylhexyl)oxy)-2-hydroxypropyl)-, dihydrochloride, 2H-Benzo(a)quinolizine, 1,3,4,6,7,11b-hexahydro-9,10-dimethoxy-2-((1,2,3,4-tetrahydro-6,7-dimethoxy-2-(3-(2-ethylhexyloxy)-2-hydroxypropyl)-1-isoquinolyl)methyl)-, dihydrochloride, 1-[(2-ethylhexyl)oxy]-3-(6',7',10,11-tetramethoxyemetan-2'-yl)propan-2-ol dihydrochloride, 2-Propanol, 1-((2-ethylhexyl)oxy)-3-(6',7',10,11-tetramethoxyemetan-2'-yl)-, dihydrochloride
| Molecular Formula | C40H64Cl2N2O6 |
|---|---|
| Molecular Weight | 738.41 g/mol |
| LogP | 8.0933 |
| Topological Polar Surface Area | 72.9 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 17 |
| Exact Mass | 738.4141 |
| Heavy Atoms | 50 |
| Complexity | 926.0 |
Chemical Identifiers
| CAS Number | 32545-64-5 |
|---|---|
| SMILES | CCCCC(CC)COCC(CN1CCC2=CC(=C(C=C2[C@H]1C[C@H]3C[C@H]4C5=CC(=C(C=C5CCN4C[C@@H]3CC)OC)OC)OC)OC)O.Cl.Cl |
| InChIKey | UAUAKKFIVNLMEA-KWEURZOMSA-N |
Product Overview
RefChem:268587 (CAS 32545-64-5), with molecular formula C40H64Cl2N2O6 and molecular weight 738.41 g/mol. IUPAC: 1-[(1R)-1-[[(2R,3R,11bS)-3-ethyl-9,10-dimethoxy-2,3,4,6,7,11b-hexahydro-1H-benzo[a]quinolizin-2-yl]methyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]-3-(2-ethylhexoxy)propan-2-ol;dihydrochloride.
Chemical Property Profile of RefChem:268587
Property Insights of RefChem:268587
The XLogP value of 8.0933 indicates that RefChem:268587 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.9 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:268587. Following Lipinski's Rule of Five, RefChem:268587 has 3 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:268587?
The CAS number of RefChem:268587 is 32545-64-5.
What is the molecular formula of RefChem:268587?
The molecular formula of RefChem:268587 is C40H64Cl2N2O6.
What is the molecular weight of RefChem:268587?
The molecular weight of RefChem:268587 is 738.41 g/mol.
Where can I buy RefChem:268587?
You can request a quote for RefChem:268587 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:268587?
Yes, KEHONG BIO provides custom synthesis services for RefChem:268587 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.