RefChem:373350
TL;DR: RefChem:373350 (CAS 5343-16-8) is a chemical compound with molecular formula C35H60I2N2O4 and molecular weight 826.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2S,3S,5S,8R,9S,10S,13S,14S,16S,17R)-17-acetyloxy-10,13-dimethyl-2,16-bis(1-methylpiperidin-1-ium-1-yl)-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate diiodide
Also Known As: KST-1A5467, 5-alpha-Androstan-3-alpha,17-beta-diol, 2-beta,16-beta-dipipecolinio-, diiodide, diacetate, 3-alpha,17-beta-Diacetoxy-2-beta,16-beta-dipiperidino-5-alpha-androstane dimethiodide, Piperidinium, 1,1'-(2-beta,16-beta-(3-alpha,17-beta-dihydroxy-5-alpha-androstanylene))bis(1-methyl-, diiodide, diacetate, (2
| Molecular Formula | C35H60I2N2O4 |
|---|---|
| Molecular Weight | 826.26 g/mol |
| LogP | 0.1185 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 826.2642 |
| Heavy Atoms | 43 |
| Complexity | 1000.0 |
Chemical Identifiers
| CAS Number | 5343-16-8 |
|---|---|
| SMILES | CC(=O)O[C@H]1C[C@@H]2CC[C@@H]3[C@@H]([C@]2(C[C@@H]1[N+]4(CCCCC4)C)C)CC[C@]5([C@H]3C[C@@H]([C@@H]5OC(=O)C)[N+]6(CCCCC6)C)C.[I-].[I-] |
| InChIKey | SRSVRTORWOTOTJ-YTGGZNJNSA-L |
Product Overview
RefChem:373350 (CAS 5343-16-8), with molecular formula C35H60I2N2O4 and molecular weight 826.26 g/mol. IUPAC: [(2S,3S,5S,8R,9S,10S,13S,14S,16S,17R)-17-acetyloxy-10,13-dimethyl-2,16-bis(1-methylpiperidin-1-ium-1-yl)-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate diiodide.
Chemical Property Profile of RefChem:373350
Property Insights of RefChem:373350
The XLogP value of 0.1185 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:373350. With a topological polar surface area (TPSA) of 52.6 Ų, RefChem:373350 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:373350 has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:373350?
The CAS number of RefChem:373350 is 5343-16-8.
What is the molecular formula of RefChem:373350?
The molecular formula of RefChem:373350 is C35H60I2N2O4.
What is the molecular weight of RefChem:373350?
The molecular weight of RefChem:373350 is 826.26 g/mol.
Where can I buy RefChem:373350?
You can request a quote for RefChem:373350 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:373350?
Yes, KEHONG BIO provides custom synthesis services for RefChem:373350 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.