Amadinone
TL;DR: Amadinone (CAS 35619-66-0) is a chemical compound with molecular formula C20H25ClO3 and molecular weight 348.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(17R)-17-acetyl-6-chloro-17-hydroxy-13-methyl-1,2,8,9,10,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-3-one
Also Known As: Amadinone, KST-1A4147, 1-(3,4,5-Trimethoxythiobenzoyl)-thiomorpholine, (17, A)-17-acetyl-6-chloro-17-hydroxyestra-4,6-dien-3-one
| Molecular Formula | C20H25ClO3 |
|---|---|
| Molecular Weight | 348.15 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 54.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 348.14923 |
| Heavy Atoms | 24 |
| Complexity | 678.0 |
Chemical Identifiers
| CAS Number | 35619-66-0 |
|---|---|
| SMILES | CC(=O)[C@]1(CCC2C1(CCC3C2C=C(C4=CC(=O)CCC34)Cl)C)O |
| InChIKey | ANJGIFXUFSBZPX-SZPXBEQZSA-N |
Product Overview
Amadinone (CAS 35619-66-0), with molecular formula C20H25ClO3 and molecular weight 348.15 g/mol. IUPAC: (17R)-17-acetyl-6-chloro-17-hydroxy-13-methyl-1,2,8,9,10,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-3-one.
Chemical Property Profile of Amadinone
Property Insights of Amadinone
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Amadinone. With a topological polar surface area (TPSA) of 54.4 Ų, Amadinone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Amadinone has 1 hydrogen bond donor(s) and 3 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 Amadinone?
The CAS number of Amadinone is 35619-66-0.
What is the molecular formula of Amadinone?
The molecular formula of Amadinone is C20H25ClO3.
What is the molecular weight of Amadinone?
The molecular weight of Amadinone is 348.15 g/mol.
Where can I buy Amadinone?
You can request a quote for Amadinone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Amadinone?
Yes, KEHONG BIO provides custom synthesis services for Amadinone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.