5β-双氢孕酮
TL;DR: 5β-双氢孕酮 (CAS 128-23-4) 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.
5β-双氢孕酮
(5R,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: 5beta-Pregnane-3,20-dione, 3,20-Pregnanedione, 5beta-Pregnan-3,20-dione, Pregnanedione, 5beta-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 |
Chemical Identifiers
| CAS Number | 128-23-4 |
|---|---|
| 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-XWOJZHJZSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5β-双氢孕酮 (CAS 128-23-4), with molecular formula C21H32O2 and molecular weight 316.24 g/mol. IUPAC: (5R,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 5β-双氢孕酮
Property Insights of 5β-双氢孕酮
The XLogP value of 4.4 indicates that 5β-双氢孕酮 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.1 Ų, 5β-双氢孕酮 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5β-双氢孕酮 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 5β-双氢孕酮?
The CAS number of 5β-双氢孕酮 is 128-23-4.
What is the molecular formula of 5β-双氢孕酮?
The molecular formula of 5β-双氢孕酮 is C21H32O2.
What is the molecular weight of 5β-双氢孕酮?
The molecular weight of 5β-双氢孕酮 is 316.24 g/mol.
Where can I buy 5β-双氢孕酮?
You can request a quote for 5β-双氢孕酮 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5β-双氢孕酮?
Yes, KEHONG BIO provides custom synthesis services for 5β-双氢孕酮 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.