5α-二氢孕酮
TL;DR: 5α-二氢孕酮 (CAS 566-65-4) is a chemical compound with molecular formula C21H32O2 and molecular weight 316.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5α-二氢孕酮
(5S,8R,9S,10S,13S,14S,17S)-17-acetyl-10,13-dimethyl-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-one
Also Known As: 3,20-Allopregnanedione, 5alpha-Pregnane-3,20-dione, 5a-Pregnane-3,20-dione, 5alpha-Dihydroprogesterone, 5-alpha-Dihydroprogesterone
| Molecular Formula | C21H32O2 |
|---|---|
| Molecular Weight | 316.24 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 34.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 316.24023 |
| Heavy Atoms | 23 |
| Complexity | 538.0 |
| Melting Point | 200 °C |
Chemical Identifiers
| CAS Number | 566-65-4 |
|---|---|
| SMILES | CC(=O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC[C@@H]4[C@@]3(CCC(=O)C4)C)C |
| InChIKey | XMRPGKVKISIQBV-BJMCWZGWSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5α-二氢孕酮 (CAS 566-65-4), with molecular formula C21H32O2 and molecular weight 316.24 g/mol. IUPAC: (5S,8R,9S,10S,13S,14S,17S)-17-acetyl-10,13-dimethyl-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-one.
Chemical Property Profile of 5α-二氢孕酮
Property Insights of 5α-二氢孕酮
The XLogP value of 4.4 indicates that 5α-二氢孕酮 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.1 Ų, 5α-二氢孕酮 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5α-二氢孕酮 has 0 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 5α-二氢孕酮?
The CAS number of 5α-二氢孕酮 is 566-65-4.
What is the molecular formula of 5α-二氢孕酮?
The molecular formula of 5α-二氢孕酮 is C21H32O2.
What is the molecular weight of 5α-二氢孕酮?
The molecular weight of 5α-二氢孕酮 is 316.24 g/mol.
Where can I buy 5α-二氢孕酮?
You can request a quote for 5α-二氢孕酮 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5α-二氢孕酮?
Yes, KEHONG BIO provides custom synthesis services for 5α-二氢孕酮 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.