Alfadolone
TL;DR: Alfadolone (CAS 566-03-0) is a chemical compound with molecular formula C21H32O4 and molecular weight 348.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-hydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-1,2,3,4,5,6,7,8,9,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-11-one
Also Known As: Alfadolone, Tetrahydro-11-dehydrocorticosterone, A-Pregnan-3, A,21-diol-11,20-dione, (3alpha)-3,21-dihydroxypregnane-11,20-dione
| Molecular Formula | C21H32O4 |
|---|---|
| Molecular Weight | 348.23 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 348.23007 |
| Heavy Atoms | 25 |
| Complexity | 586.0 |
Chemical Identifiers
| CAS Number | 566-03-0 |
|---|---|
| SMILES | CC12CCC(CC1CCC3C2C(=O)CC4(C3CCC4C(=O)CO)C)O |
| InChIKey | XWYBFXIUISNTQG-UHFFFAOYSA-N |
Product Overview
Alfadolone (CAS 566-03-0), with molecular formula C21H32O4 and molecular weight 348.23 g/mol. IUPAC: 3-hydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-1,2,3,4,5,6,7,8,9,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-11-one.
Chemical Property Profile of Alfadolone
Property Insights of Alfadolone
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Alfadolone. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Alfadolone. Following Lipinski's Rule of Five, Alfadolone has 2 hydrogen bond donor(s) and 4 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 Alfadolone?
The CAS number of Alfadolone is 566-03-0.
What is the molecular formula of Alfadolone?
The molecular formula of Alfadolone is C21H32O4.
What is the molecular weight of Alfadolone?
The molecular weight of Alfadolone is 348.23 g/mol.
Where can I buy Alfadolone?
You can request a quote for Alfadolone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Alfadolone?
Yes, KEHONG BIO provides custom synthesis services for Alfadolone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.