3beta-Hydroxy-16alpha,17-dimethylpregn-5-en-20-one
TL;DR: 3beta-Hydroxy-16alpha,17-dimethylpregn-5-en-20-one (CAS 10069-31-5) is a chemical compound with molecular formula C23H36O2 and molecular weight 344.27 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(3S,8R,9S,10R,13S,14S,16R,17S)-3-hydroxy-10,13,16,17-tetramethyl-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-yl]ethanone
Also Known As: 3beta-Hydroxy-16alpha,17-dimethylpregn-5-en-20-one, (3ss,16a)-3-Hydroxy-16,17-dimethyl-pregn-5-en-20-one, 16, A,17, A-Dimethyl-
| Molecular Formula | C23H36O2 |
|---|---|
| Molecular Weight | 344.27 g/mol |
| LogP | 5.1514 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 344.27155 |
| Heavy Atoms | 25 |
| Complexity | 621.58234 |
Chemical Identifiers
| CAS Number | 10069-31-5 |
|---|---|
| SMILES | C[C@@H]1C[C@H]2[C@@H]3CC=C4C[C@H](CC[C@@]4([C@H]3CC[C@@]2([C@@]1(C)C(=O)C)C)C)O |
Product Overview
3beta-Hydroxy-16alpha,17-dimethylpregn-5-en-20-one (CAS 10069-31-5), with molecular formula C23H36O2 and molecular weight 344.27 g/mol. IUPAC: 1-[(3S,8R,9S,10R,13S,14S,16R,17S)-3-hydroxy-10,13,16,17-tetramethyl-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-yl]ethanone.
Chemical Property Profile of 3beta-Hydroxy-16alpha,17-dimethylpregn-5-en-20-one
Property Insights of 3beta-Hydroxy-16alpha,17-dimethylpregn-5-en-20-one
The XLogP value of 5.1514 indicates that 3beta-Hydroxy-16alpha,17-dimethylpregn-5-en-20-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, 3beta-Hydroxy-16alpha,17-dimethylpregn-5-en-20-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3beta-Hydroxy-16alpha,17-dimethylpregn-5-en-20-one has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3beta-Hydroxy-16alpha,17-dimethylpregn-5-en-20-one?
The CAS number of 3beta-Hydroxy-16alpha,17-dimethylpregn-5-en-20-one is 10069-31-5.
What is the molecular formula of 3beta-Hydroxy-16alpha,17-dimethylpregn-5-en-20-one?
The molecular formula of 3beta-Hydroxy-16alpha,17-dimethylpregn-5-en-20-one is C23H36O2.
What is the molecular weight of 3beta-Hydroxy-16alpha,17-dimethylpregn-5-en-20-one?
The molecular weight of 3beta-Hydroxy-16alpha,17-dimethylpregn-5-en-20-one is 344.27 g/mol.
Where can I buy 3beta-Hydroxy-16alpha,17-dimethylpregn-5-en-20-one?
You can request a quote for 3beta-Hydroxy-16alpha,17-dimethylpregn-5-en-20-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3beta-Hydroxy-16alpha,17-dimethylpregn-5-en-20-one?
Yes, KEHONG BIO provides custom synthesis services for 3beta-Hydroxy-16alpha,17-dimethylpregn-5-en-20-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.