16,17-Didehydro-11-oxoprogesterone
TL;DR: 16,17-Didehydro-11-oxoprogesterone (CAS 1882-86-6) is a chemical compound with molecular formula C21H26O3 and molecular weight 326.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(8S,9S,10R,13S,14S)-17-acetyl-10,13-dimethyl-2,6,7,8,9,12,14,15-octahydro-1H-cyclopenta[a]phenanthrene-3,11-dione
Also Known As: 16,17-Didehydro-11-oxoprogesterone, Pregna-4,16-diene-3,11,20-trione, 4,16-pregnadien-3,11,20-trione, Pregna-4,16-diene-3,11,20-trione(6CI,7CI,8CI,9CI), (8S,9S,10R,13S,14S)-17-acetyl-10,13-dimethyl-2,6,7,8,9,12,14
| Molecular Formula | C21H26O3 |
|---|---|
| Molecular Weight | 326.19 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 51.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 326.1882 |
| Heavy Atoms | 24 |
| Complexity | 713.0 |
Chemical Identifiers
| CAS Number | 1882-86-6 |
|---|---|
| SMILES | CC(=O)C1=CC[C@@H]2[C@@]1(CC(=O)[C@H]3[C@H]2CCC4=CC(=O)CC[C@]34C)C |
| InChIKey | IKTWAVWPFLQACH-RJQCYMMPSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
16,17-Didehydro-11-oxoprogesterone (CAS 1882-86-6), with molecular formula C21H26O3 and molecular weight 326.19 g/mol. IUPAC: (8S,9S,10R,13S,14S)-17-acetyl-10,13-dimethyl-2,6,7,8,9,12,14,15-octahydro-1H-cyclopenta[a]phenanthrene-3,11-dione.
Chemical Property Profile of 16,17-Didehydro-11-oxoprogesterone
Property Insights of 16,17-Didehydro-11-oxoprogesterone
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 16,17-Didehydro-11-oxoprogesterone. With a topological polar surface area (TPSA) of 51.2 Ų, 16,17-Didehydro-11-oxoprogesterone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 16,17-Didehydro-11-oxoprogesterone has 0 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 16,17-Didehydro-11-oxoprogesterone?
The CAS number of 16,17-Didehydro-11-oxoprogesterone is 1882-86-6.
What is the molecular formula of 16,17-Didehydro-11-oxoprogesterone?
The molecular formula of 16,17-Didehydro-11-oxoprogesterone is C21H26O3.
What is the molecular weight of 16,17-Didehydro-11-oxoprogesterone?
The molecular weight of 16,17-Didehydro-11-oxoprogesterone is 326.19 g/mol.
Where can I buy 16,17-Didehydro-11-oxoprogesterone?
You can request a quote for 16,17-Didehydro-11-oxoprogesterone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 16,17-Didehydro-11-oxoprogesterone?
Yes, KEHONG BIO provides custom synthesis services for 16,17-Didehydro-11-oxoprogesterone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.