11,17,21-三羟基孕甾-1,4-二烯-3,20-二酮
TL;DR: 11,17,21-三羟基孕甾-1,4-二烯-3,20-二酮 (CAS 50-24-8) is a chemical compound with molecular formula C21H28O5 and molecular weight 360.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
11,17,21-三羟基孕甾-1,4-二烯-3,20-二酮
11,17-dihydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-one
Also Known As: prednisolone, prednisone, Epiprednisolone, 1-Dehydrocortisol, 1-Dehydrohydrocortisone
| Molecular Formula | C21H28O5 |
|---|---|
| Molecular Weight | 360.19 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 94.8 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 360.19366 |
| Heavy Atoms | 26 |
| Complexity | 724.0 |
Chemical Identifiers
| CAS Number | 50-24-8 |
|---|---|
| SMILES | CC12CC(C3C(C1CCC2(C(=O)CO)O)CCC4=CC(=O)C=CC34C)O |
| InChIKey | OIGNJSKKLXVSLS-UHFFFAOYSA-N |
Product Overview
11,17,21-三羟基孕甾-1,4-二烯-3,20-二酮 (CAS 50-24-8), with molecular formula C21H28O5 and molecular weight 360.19 g/mol. IUPAC: 11,17-dihydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-one.
Chemical Property Profile of 11,17,21-三羟基孕甾-1,4-二烯-3,20-二酮
Property Insights of 11,17,21-三羟基孕甾-1,4-二烯-3,20-二酮
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 11,17,21-三羟基孕甾-1,4-二烯-3,20-二酮. The TPSA of 94.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 11,17,21-三羟基孕甾-1,4-二烯-3,20-二酮. Following Lipinski's Rule of Five, 11,17,21-三羟基孕甾-1,4-二烯-3,20-二酮 has 3 hydrogen bond donor(s) and 5 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 11,17,21-三羟基孕甾-1,4-二烯-3,20-二酮?
The CAS number of 11,17,21-三羟基孕甾-1,4-二烯-3,20-二酮 is 50-24-8.
What is the molecular formula of 11,17,21-三羟基孕甾-1,4-二烯-3,20-二酮?
The molecular formula of 11,17,21-三羟基孕甾-1,4-二烯-3,20-二酮 is C21H28O5.
What is the molecular weight of 11,17,21-三羟基孕甾-1,4-二烯-3,20-二酮?
The molecular weight of 11,17,21-三羟基孕甾-1,4-二烯-3,20-二酮 is 360.19 g/mol.
Where can I buy 11,17,21-三羟基孕甾-1,4-二烯-3,20-二酮?
You can request a quote for 11,17,21-三羟基孕甾-1,4-二烯-3,20-二酮 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 11,17,21-三羟基孕甾-1,4-二烯-3,20-二酮?
Yes, KEHONG BIO provides custom synthesis services for 11,17,21-三羟基孕甾-1,4-二烯-3,20-二酮 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.