2,16-Dipiperidinoandrostane-3,17-diol dipivalate
TL;DR: 2,16-Dipiperidinoandrostane-3,17-diol dipivalate (CAS 63665-41-8) is a chemical compound with molecular formula C39H66N2O4 and molecular weight 626.50 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-(2,2-dimethylpropanoyloxy)-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]phenanthren-3-yl] 2,2-dimethylpropanoate
Also Known As: Sid 701771, 2,16-Dipiperidinoandrostane-3,17-diol dipivalate, 2,16-dipiperidinoandrostane-3,17-dioldipivalate, [(2S,3S,5S,8R,9S,10S,13S,14S,16S,17R)-17-(2,2-dimethylpropanoyloxy)-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]phenanthren-3-yl] 2,2-dimethylpropanoate, Androstane-3,17-diol, 2,16-di-1-piperidinyl-, bis(2,2-dimethylpropanoate) (ester), (2beta,3alpha,5alpha,16beta,17beta)-
| Molecular Formula | C39H66N2O4 |
|---|---|
| Molecular Weight | 626.50 g/mol |
| LogP | 9.3 |
| Topological Polar Surface Area | 59.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 626.50226 |
| Heavy Atoms | 45 |
| Complexity | 1080.0 |
Chemical Identifiers
| CAS Number | 63665-41-8 |
|---|---|
| SMILES | C[C@]12CC[C@H]3[C@H]([C@@H]1C[C@@H]([C@@H]2OC(=O)C(C)(C)C)N4CCCCC4)CC[C@@H]5[C@@]3(C[C@@H]([C@H](C5)OC(=O)C(C)(C)C)N6CCCCC6)C |
| InChIKey | UAXYDQGRJRUBNC-ZMFKFFRCSA-N |
Product Overview
2,16-Dipiperidinoandrostane-3,17-diol dipivalate (CAS 63665-41-8), with molecular formula C39H66N2O4 and molecular weight 626.50 g/mol. IUPAC: [(2S,3S,5S,8R,9S,10S,13S,14S,16S,17R)-17-(2,2-dimethylpropanoyloxy)-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]phenanthren-3-yl] 2,2-dimethylpropanoate.
Chemical Property Profile of 2,16-Dipiperidinoandrostane-3,17-diol dipivalate
Property Insights of 2,16-Dipiperidinoandrostane-3,17-diol dipivalate
The XLogP value of 9.3 indicates that 2,16-Dipiperidinoandrostane-3,17-diol dipivalate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.1 Ų, 2,16-Dipiperidinoandrostane-3,17-diol dipivalate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,16-Dipiperidinoandrostane-3,17-diol dipivalate 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 2,16-Dipiperidinoandrostane-3,17-diol dipivalate?
The CAS number of 2,16-Dipiperidinoandrostane-3,17-diol dipivalate is 63665-41-8.
What is the molecular formula of 2,16-Dipiperidinoandrostane-3,17-diol dipivalate?
The molecular formula of 2,16-Dipiperidinoandrostane-3,17-diol dipivalate is C39H66N2O4.
What is the molecular weight of 2,16-Dipiperidinoandrostane-3,17-diol dipivalate?
The molecular weight of 2,16-Dipiperidinoandrostane-3,17-diol dipivalate is 626.50 g/mol.
Where can I buy 2,16-Dipiperidinoandrostane-3,17-diol dipivalate?
You can request a quote for 2,16-Dipiperidinoandrostane-3,17-diol dipivalate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,16-Dipiperidinoandrostane-3,17-diol dipivalate?
Yes, KEHONG BIO provides custom synthesis services for 2,16-Dipiperidinoandrostane-3,17-diol dipivalate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.