9beta,10alpha,17alpha-Pregna-4,6-diene-3,20-dione
TL;DR: 9beta,10alpha,17alpha-Pregna-4,6-diene-3,20-dione (CAS 246038-13-1) is a chemical compound with molecular formula C21H28O2 and molecular weight 312.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(8S,9R,10S,13S,14S,17R)-17-acetyl-10,13-dimethyl-1,2,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-one
Also Known As: dydrogesterone, Dydrogesterone EP Impurity C, 17-Dydrogesterone, 17?-Dydrogesterone, 9beta,10alpha,17alpha-Pregna-4,6-diene-3,20-dione
| Molecular Formula | C21H28O2 |
|---|---|
| Molecular Weight | 312.21 g/mol |
| LogP | 4.4995 |
| Topological Polar Surface Area | 34.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 312.20892 |
| Heavy Atoms | 23 |
| Complexity | 627.7528 |
Chemical Identifiers
| CAS Number | 246038-13-1 |
|---|---|
| SMILES | CC(=O)[C@@H]1CC[C@@H]2[C@@]1(CC[C@@H]3[C@H]2C=CC4=CC(=O)CC[C@@]34C)C |
Product Overview
9beta,10alpha,17alpha-Pregna-4,6-diene-3,20-dione (CAS 246038-13-1), with molecular formula C21H28O2 and molecular weight 312.21 g/mol. IUPAC: (8S,9R,10S,13S,14S,17R)-17-acetyl-10,13-dimethyl-1,2,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-one.
Chemical Property Profile of 9beta,10alpha,17alpha-Pregna-4,6-diene-3,20-dione
Property Insights of 9beta,10alpha,17alpha-Pregna-4,6-diene-3,20-dione
The XLogP value of 4.4995 indicates that 9beta,10alpha,17alpha-Pregna-4,6-diene-3,20-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.14 Ų, 9beta,10alpha,17alpha-Pregna-4,6-diene-3,20-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 9beta,10alpha,17alpha-Pregna-4,6-diene-3,20-dione 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 9beta,10alpha,17alpha-Pregna-4,6-diene-3,20-dione?
The CAS number of 9beta,10alpha,17alpha-Pregna-4,6-diene-3,20-dione is 246038-13-1.
What is the molecular formula of 9beta,10alpha,17alpha-Pregna-4,6-diene-3,20-dione?
The molecular formula of 9beta,10alpha,17alpha-Pregna-4,6-diene-3,20-dione is C21H28O2.
What is the molecular weight of 9beta,10alpha,17alpha-Pregna-4,6-diene-3,20-dione?
The molecular weight of 9beta,10alpha,17alpha-Pregna-4,6-diene-3,20-dione is 312.21 g/mol.
Where can I buy 9beta,10alpha,17alpha-Pregna-4,6-diene-3,20-dione?
You can request a quote for 9beta,10alpha,17alpha-Pregna-4,6-diene-3,20-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9beta,10alpha,17alpha-Pregna-4,6-diene-3,20-dione?
Yes, KEHONG BIO provides custom synthesis services for 9beta,10alpha,17alpha-Pregna-4,6-diene-3,20-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.