2alpha-(Hydroxymethyl)-5alpha-androstane-3beta,17beta-diol
TL;DR: 2alpha-(Hydroxymethyl)-5alpha-androstane-3beta,17beta-diol (CAS 85885-77-4) is a chemical compound with molecular formula C20H34O3 and molecular weight 322.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S,3R,5S,8R,9S,10S,13S,14S,17S)-2-(hydroxymethyl)-10,13-dimethyl-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: 2alpha-(Hydroxymethyl)-5alpha-androstane-3beta,17beta-diol, J2.791.383K, A-(hydroxymethyl)-5, A-androstane-3, A,17
| Molecular Formula | C20H34O3 |
|---|---|
| Molecular Weight | 322.25 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 60.7 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 322.2508 |
| Heavy Atoms | 23 |
| Complexity | 466.0 |
Chemical Identifiers
| CAS Number | 85885-77-4 |
|---|---|
| SMILES | C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2O)CC[C@@H]4[C@@]3(C[C@H]([C@@H](C4)O)CO)C |
| InChIKey | GMNUCAFZYMWGOG-GABTWMSCSA-N |
Product Overview
2alpha-(Hydroxymethyl)-5alpha-androstane-3beta,17beta-diol (CAS 85885-77-4), with molecular formula C20H34O3 and molecular weight 322.25 g/mol. IUPAC: (2S,3R,5S,8R,9S,10S,13S,14S,17S)-2-(hydroxymethyl)-10,13-dimethyl-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 2alpha-(Hydroxymethyl)-5alpha-androstane-3beta,17beta-diol
Property Insights of 2alpha-(Hydroxymethyl)-5alpha-androstane-3beta,17beta-diol
The XLogP value of 3.9 indicates that 2alpha-(Hydroxymethyl)-5alpha-androstane-3beta,17beta-diol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 2alpha-(Hydroxymethyl)-5alpha-androstane-3beta,17beta-diol. Following Lipinski's Rule of Five, 2alpha-(Hydroxymethyl)-5alpha-androstane-3beta,17beta-diol has 3 hydrogen bond donor(s) and 3 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 2alpha-(Hydroxymethyl)-5alpha-androstane-3beta,17beta-diol?
The CAS number of 2alpha-(Hydroxymethyl)-5alpha-androstane-3beta,17beta-diol is 85885-77-4.
What is the molecular formula of 2alpha-(Hydroxymethyl)-5alpha-androstane-3beta,17beta-diol?
The molecular formula of 2alpha-(Hydroxymethyl)-5alpha-androstane-3beta,17beta-diol is C20H34O3.
What is the molecular weight of 2alpha-(Hydroxymethyl)-5alpha-androstane-3beta,17beta-diol?
The molecular weight of 2alpha-(Hydroxymethyl)-5alpha-androstane-3beta,17beta-diol is 322.25 g/mol.
Where can I buy 2alpha-(Hydroxymethyl)-5alpha-androstane-3beta,17beta-diol?
You can request a quote for 2alpha-(Hydroxymethyl)-5alpha-androstane-3beta,17beta-diol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2alpha-(Hydroxymethyl)-5alpha-androstane-3beta,17beta-diol?
Yes, KEHONG BIO provides custom synthesis services for 2alpha-(Hydroxymethyl)-5alpha-androstane-3beta,17beta-diol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.