3-Hydroxyandrost-4-en-17-one
TL;DR: 3-Hydroxyandrost-4-en-17-one (CAS 2791-99-3) is a chemical compound with molecular formula C19H28O2 and molecular weight 288.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(8R,9S,10R,13S,14S)-3-hydroxy-10,13-dimethyl-1,2,3,6,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-one
Also Known As: 3-hydroxyandrost-4-en-17-one, 3-Hydroxy-4-androsten-17-one, 3-Hydroxyandrosta-4-ene-17-one, 3alpha-Hydroxy-4-androsten-17-one, Androst-4-en-17-one,3-hydroxy-, (3a)-
| Molecular Formula | C19H28O2 |
|---|---|
| Molecular Weight | 288.21 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 288.20892 |
| Heavy Atoms | 21 |
| Complexity | 508.0 |
Chemical Identifiers
| CAS Number | 2791-99-3 |
|---|---|
| SMILES | C[C@]12CCC(C=C1CC[C@@H]3[C@@H]2CC[C@]4([C@H]3CCC4=O)C)O |
| InChIKey | VMYTXBKVYDESSJ-HQEMIIEJSA-N |
Product Overview
3-Hydroxyandrost-4-en-17-one (CAS 2791-99-3), with molecular formula C19H28O2 and molecular weight 288.21 g/mol. IUPAC: (8R,9S,10R,13S,14S)-3-hydroxy-10,13-dimethyl-1,2,3,6,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-one.
Chemical Property Profile of 3-Hydroxyandrost-4-en-17-one
Property Insights of 3-Hydroxyandrost-4-en-17-one
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Hydroxyandrost-4-en-17-one. With a topological polar surface area (TPSA) of 37.3 Ų, 3-Hydroxyandrost-4-en-17-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Hydroxyandrost-4-en-17-one has 1 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 3-Hydroxyandrost-4-en-17-one?
The CAS number of 3-Hydroxyandrost-4-en-17-one is 2791-99-3.
What is the molecular formula of 3-Hydroxyandrost-4-en-17-one?
The molecular formula of 3-Hydroxyandrost-4-en-17-one is C19H28O2.
What is the molecular weight of 3-Hydroxyandrost-4-en-17-one?
The molecular weight of 3-Hydroxyandrost-4-en-17-one is 288.21 g/mol.
Where can I buy 3-Hydroxyandrost-4-en-17-one?
You can request a quote for 3-Hydroxyandrost-4-en-17-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Hydroxyandrost-4-en-17-one?
Yes, KEHONG BIO provides custom synthesis services for 3-Hydroxyandrost-4-en-17-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.