Org 21465
TL;DR: Org 21465 (CAS 167946-96-5) is a chemical compound with molecular formula C27H43NO4 and molecular weight 445.32 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S,3S,5S,8S,9S,10S,13S,14S,17S)-17-acetyl-2-(2,2-dimethylmorpholin-4-yl)-3-hydroxy-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: Org 21465, (2S,3S,5S,8S,9S,10S,13S,14S,17S)-17-acetyl-2-(2,2-dimethylmorpholin-4-yl)-3-hydroxy-10,13-dimethyl-1,2,3,4,5,6,7,8,9,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-11-one, (2S,3S,5S,8S,9S,10S,13S,14S,17S)-17-acetyl-2-(2,2-dimethylmorpholino)-3-hydroxy-10,13-dimethylhexadecahydro-11H-cyclopenta[a]phenanthren-11-one, 2beta-(2,2-Dimethylmorpholino)-3alpha-hydroxy-5alpha-pregnane-11,20-dione, 3alpha-Hydroxy-2beta-(2,2-dimethylmorpholino)-5alpha-pregna-11,20-dione
| Molecular Formula | C27H43NO4 |
|---|---|
| Molecular Weight | 445.32 g/mol |
| LogP | 3.8635 |
| Topological Polar Surface Area | 66.84 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 445.3192 |
| Heavy Atoms | 32 |
| Complexity | 794.5259 |
Chemical Identifiers
| CAS Number | 167946-96-5 |
|---|---|
| SMILES | CC(=O)[C@H]1CC[C@@H]2[C@@]1(CC(=O)[C@H]3[C@H]2CC[C@@H]4[C@@]3(C[C@@H]([C@H](C4)O)N5CCOC(C5)(C)C)C)C |
Product Overview
Org 21465 (CAS 167946-96-5), with molecular formula C27H43NO4 and molecular weight 445.32 g/mol. IUPAC: (2S,3S,5S,8S,9S,10S,13S,14S,17S)-17-acetyl-2-(2,2-dimethylmorpholin-4-yl)-3-hydroxy-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 Org 21465
Property Insights of Org 21465
The XLogP value of 3.8635 indicates that Org 21465 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.84 Ų falls within the moderate polarity range, balancing permeability and solubility for Org 21465. Following Lipinski's Rule of Five, Org 21465 has 1 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 Org 21465?
The CAS number of Org 21465 is 167946-96-5.
What is the molecular formula of Org 21465?
The molecular formula of Org 21465 is C27H43NO4.
What is the molecular weight of Org 21465?
The molecular weight of Org 21465 is 445.32 g/mol.
Where can I buy Org 21465?
You can request a quote for Org 21465 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Org 21465?
Yes, KEHONG BIO provides custom synthesis services for Org 21465 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.