A-Norandrostane-2alpha,17alpha-diethynyl-2beta,17beta-diol
TL;DR: A-Norandrostane-2alpha,17alpha-diethynyl-2beta,17beta-diol (CAS 1045-30-3) is a chemical compound with molecular formula C22H30O2 and molecular weight 326.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S,3aS,3bS,5aS,6R,8aS,8bR,10aS)-2,6-diethynyl-3a,5a-dimethyl-1,3,3b,4,5,7,8,8a,8b,9,10,10a-dodecahydroindeno[5,4-e]indene-2,6-diol
Also Known As: Anordiol, AF 45, KST-1A0443, A-Norandrostane-2alpha,17alpha-diethynyl-2beta,17beta-diol, H241
| Molecular Formula | C22H30O2 |
|---|---|
| Molecular Weight | 326.22 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 40.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 326.22458 |
| Heavy Atoms | 24 |
| Complexity | 664.0 |
Chemical Identifiers
| CAS Number | 1045-30-3 |
|---|---|
| SMILES | C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@]2(C#C)O)CC[C@@H]4[C@@]3(C[C@@](C4)(C#C)O)C |
| InChIKey | HUUUMTTWAPMBMU-KGIOUCCPSA-N |
Product Overview
A-Norandrostane-2alpha,17alpha-diethynyl-2beta,17beta-diol (CAS 1045-30-3), with molecular formula C22H30O2 and molecular weight 326.22 g/mol. IUPAC: (2S,3aS,3bS,5aS,6R,8aS,8bR,10aS)-2,6-diethynyl-3a,5a-dimethyl-1,3,3b,4,5,7,8,8a,8b,9,10,10a-dodecahydroindeno[5,4-e]indene-2,6-diol.
Chemical Property Profile of A-Norandrostane-2alpha,17alpha-diethynyl-2beta,17beta-diol
Property Insights of A-Norandrostane-2alpha,17alpha-diethynyl-2beta,17beta-diol
The XLogP value of 3.6 indicates that A-Norandrostane-2alpha,17alpha-diethynyl-2beta,17beta-diol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.5 Ų, A-Norandrostane-2alpha,17alpha-diethynyl-2beta,17beta-diol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, A-Norandrostane-2alpha,17alpha-diethynyl-2beta,17beta-diol has 2 hydrogen bond donor(s) and 2 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 A-Norandrostane-2alpha,17alpha-diethynyl-2beta,17beta-diol?
The CAS number of A-Norandrostane-2alpha,17alpha-diethynyl-2beta,17beta-diol is 1045-30-3.
What is the molecular formula of A-Norandrostane-2alpha,17alpha-diethynyl-2beta,17beta-diol?
The molecular formula of A-Norandrostane-2alpha,17alpha-diethynyl-2beta,17beta-diol is C22H30O2.
What is the molecular weight of A-Norandrostane-2alpha,17alpha-diethynyl-2beta,17beta-diol?
The molecular weight of A-Norandrostane-2alpha,17alpha-diethynyl-2beta,17beta-diol is 326.22 g/mol.
Where can I buy A-Norandrostane-2alpha,17alpha-diethynyl-2beta,17beta-diol?
You can request a quote for A-Norandrostane-2alpha,17alpha-diethynyl-2beta,17beta-diol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A-Norandrostane-2alpha,17alpha-diethynyl-2beta,17beta-diol?
Yes, KEHONG BIO provides custom synthesis services for A-Norandrostane-2alpha,17alpha-diethynyl-2beta,17beta-diol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.