(2beta,3alpha,5alpha,16beta,17beta)-2,16-Di-1-piperidinylandrostane-3,17-diol
TL;DR: (2beta,3alpha,5alpha,16beta,17beta)-2,16-Di-1-piperidinylandrostane-3,17-diol (CAS 13522-16-2) is a chemical compound with molecular formula C29H50N2O2 and molecular weight 458.39 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)-10,13-dimethyl-2,16-di(piperidin-1-yl)-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,17-diol
Also Known As: Z-Agalao, 2,16-Dipiperidin-1-ylandrosta-3,17-diol, Z-Aib-gly-aib-leu-aib-otbu, Vecuronium Bromide Impurity 8, 2,16-Dipiperidin-1-yl-androsta-3,17-diol
| Molecular Formula | C29H50N2O2 |
|---|---|
| Molecular Weight | 458.39 g/mol |
| LogP | 5.4 |
| Topological Polar Surface Area | 46.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 458.38724 |
| Heavy Atoms | 33 |
| Complexity | 704.0 |
Chemical Identifiers
| CAS Number | 13522-16-2 |
|---|---|
| SMILES | C[C@]12CC[C@H]3[C@H]([C@@H]1C[C@@H]([C@@H]2O)N4CCCCC4)CC[C@@H]5[C@@]3(C[C@@H]([C@H](C5)O)N6CCCCC6)C |
| InChIKey | SMEIBKQQBOLIMJ-RIQJFVKASA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
(2beta,3alpha,5alpha,16beta,17beta)-2,16-Di-1-piperidinylandrostane-3,17-diol (CAS 13522-16-2), with molecular formula C29H50N2O2 and molecular weight 458.39 g/mol. IUPAC: (2S,3S,5S,8R,9S,10S,13S,14S,16S,17R)-10,13-dimethyl-2,16-di(piperidin-1-yl)-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,17-diol.
Chemical Property Profile of (2beta,3alpha,5alpha,16beta,17beta)-2,16-Di-1-piperidinylandrostane-3,17-diol
Property Insights of (2beta,3alpha,5alpha,16beta,17beta)-2,16-Di-1-piperidinylandrostane-3,17-diol
The XLogP value of 5.4 indicates that (2beta,3alpha,5alpha,16beta,17beta)-2,16-Di-1-piperidinylandrostane-3,17-diol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.9 Ų, (2beta,3alpha,5alpha,16beta,17beta)-2,16-Di-1-piperidinylandrostane-3,17-diol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2beta,3alpha,5alpha,16beta,17beta)-2,16-Di-1-piperidinylandrostane-3,17-diol has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (2beta,3alpha,5alpha,16beta,17beta)-2,16-Di-1-piperidinylandrostane-3,17-diol?
The CAS number of (2beta,3alpha,5alpha,16beta,17beta)-2,16-Di-1-piperidinylandrostane-3,17-diol is 13522-16-2.
What is the molecular formula of (2beta,3alpha,5alpha,16beta,17beta)-2,16-Di-1-piperidinylandrostane-3,17-diol?
The molecular formula of (2beta,3alpha,5alpha,16beta,17beta)-2,16-Di-1-piperidinylandrostane-3,17-diol is C29H50N2O2.
What is the molecular weight of (2beta,3alpha,5alpha,16beta,17beta)-2,16-Di-1-piperidinylandrostane-3,17-diol?
The molecular weight of (2beta,3alpha,5alpha,16beta,17beta)-2,16-Di-1-piperidinylandrostane-3,17-diol is 458.39 g/mol.
Where can I buy (2beta,3alpha,5alpha,16beta,17beta)-2,16-Di-1-piperidinylandrostane-3,17-diol?
You can request a quote for (2beta,3alpha,5alpha,16beta,17beta)-2,16-Di-1-piperidinylandrostane-3,17-diol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2beta,3alpha,5alpha,16beta,17beta)-2,16-Di-1-piperidinylandrostane-3,17-diol?
Yes, KEHONG BIO provides custom synthesis services for (2beta,3alpha,5alpha,16beta,17beta)-2,16-Di-1-piperidinylandrostane-3,17-diol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.