ANDROST-5-ENE-3-beta,17-beta-DIOL, 17-alpha-BUTADIYNYL-
TL;DR: ANDROST-5-ENE-3-beta,17-beta-DIOL, 17-alpha-BUTADIYNYL- (CAS 2010-48-2) is a chemical compound with molecular formula C23H30O2 and molecular weight 338.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3S,8R,9S,10R,13S,14S,17S)-17-buta-1,3-diynyl-10,13-dimethyl-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthrene-3,17-diol
Also Known As: 17-alpha-Butadiynylandrost-5-ene-3-beta,17-beta-diol, ANDROST-5-ENE-3-beta,17-beta-DIOL, 17-alpha-BUTADIYNYL-, 17-alpha-Butadiynyl-3-beta,17-beta-dihydroxy-5-androsten-17-one, (1S,3aS,3bR,7S,9aR,9bS,11aS)-1-(Buta-1,3-diyn-1-yl)-9a,11a-dimethyl-2,3,3a,3b,4,6,7,8,9,9a,9b,10,11,11a-tetradecahydro-1H-cyclopenta[a]phenanthrene-1,7-diol, (3S,8R,9S,10R,13S,14S,17S)-17-buta-1,3-diynyl-10,13-dimethyl-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthrene-3,17-diol
| Molecular Formula | C23H30O2 |
|---|---|
| Molecular Weight | 338.22 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 40.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 338.22458 |
| Heavy Atoms | 25 |
| Complexity | 727.0 |
Chemical Identifiers
| CAS Number | 2010-48-2 |
|---|---|
| SMILES | C[C@]12CC[C@@H](CC1=CC[C@@H]3[C@@H]2CC[C@]4([C@H]3CC[C@]4(C#CC#C)O)C)O |
| InChIKey | SGIJLKUYOLZWEV-KIYFCUGLSA-N |
Product Overview
ANDROST-5-ENE-3-beta,17-beta-DIOL, 17-alpha-BUTADIYNYL- (CAS 2010-48-2), with molecular formula C23H30O2 and molecular weight 338.22 g/mol. IUPAC: (3S,8R,9S,10R,13S,14S,17S)-17-buta-1,3-diynyl-10,13-dimethyl-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthrene-3,17-diol.
Chemical Property Profile of ANDROST-5-ENE-3-beta,17-beta-DIOL, 17-alpha-BUTADIYNYL-
Property Insights of ANDROST-5-ENE-3-beta,17-beta-DIOL, 17-alpha-BUTADIYNYL-
The XLogP value of 3.8 indicates that ANDROST-5-ENE-3-beta,17-beta-DIOL, 17-alpha-BUTADIYNYL- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.5 Ų, ANDROST-5-ENE-3-beta,17-beta-DIOL, 17-alpha-BUTADIYNYL- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ANDROST-5-ENE-3-beta,17-beta-DIOL, 17-alpha-BUTADIYNYL- 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 ANDROST-5-ENE-3-beta,17-beta-DIOL, 17-alpha-BUTADIYNYL-?
The CAS number of ANDROST-5-ENE-3-beta,17-beta-DIOL, 17-alpha-BUTADIYNYL- is 2010-48-2.
What is the molecular formula of ANDROST-5-ENE-3-beta,17-beta-DIOL, 17-alpha-BUTADIYNYL-?
The molecular formula of ANDROST-5-ENE-3-beta,17-beta-DIOL, 17-alpha-BUTADIYNYL- is C23H30O2.
What is the molecular weight of ANDROST-5-ENE-3-beta,17-beta-DIOL, 17-alpha-BUTADIYNYL-?
The molecular weight of ANDROST-5-ENE-3-beta,17-beta-DIOL, 17-alpha-BUTADIYNYL- is 338.22 g/mol.
Where can I buy ANDROST-5-ENE-3-beta,17-beta-DIOL, 17-alpha-BUTADIYNYL-?
You can request a quote for ANDROST-5-ENE-3-beta,17-beta-DIOL, 17-alpha-BUTADIYNYL- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ANDROST-5-ENE-3-beta,17-beta-DIOL, 17-alpha-BUTADIYNYL-?
Yes, KEHONG BIO provides custom synthesis services for ANDROST-5-ENE-3-beta,17-beta-DIOL, 17-alpha-BUTADIYNYL- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.