15-Fluoropregn-4-ene-3,20-dione
TL;DR: 15-Fluoropregn-4-ene-3,20-dione (CAS 81069-02-5) is a chemical compound with molecular formula C21H29FO2 and molecular weight 332.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
17-acetyl-15-fluoro-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one
Also Known As: 15-fluoropregn-4-ene-3,20-dione, Pregn-4-ene-3,20-dione,15b-fluoro- (7CI,8CI), 1,3-diethyl-8-phenyl-3,7-dihydro-1h-purine-2,6-dione, 17-acetyl-15-fluoro-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one
| Molecular Formula | C21H29FO2 |
|---|---|
| Molecular Weight | 332.22 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 34.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 332.21515 |
| Heavy Atoms | 24 |
| Complexity | 623.0 |
Chemical Identifiers
| CAS Number | 81069-02-5 |
|---|---|
| SMILES | CC(=O)C1CC(C2C1(CCC3C2CCC4=CC(=O)CCC34C)C)F |
| InChIKey | KAWQTQXJOMANFC-UHFFFAOYSA-N |
Product Overview
15-Fluoropregn-4-ene-3,20-dione (CAS 81069-02-5), with molecular formula C21H29FO2 and molecular weight 332.22 g/mol. IUPAC: 17-acetyl-15-fluoro-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one.
Chemical Property Profile of 15-Fluoropregn-4-ene-3,20-dione
Property Insights of 15-Fluoropregn-4-ene-3,20-dione
The XLogP value of 3.7 indicates that 15-Fluoropregn-4-ene-3,20-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.1 Ų, 15-Fluoropregn-4-ene-3,20-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 15-Fluoropregn-4-ene-3,20-dione 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 15-Fluoropregn-4-ene-3,20-dione?
The CAS number of 15-Fluoropregn-4-ene-3,20-dione is 81069-02-5.
What is the molecular formula of 15-Fluoropregn-4-ene-3,20-dione?
The molecular formula of 15-Fluoropregn-4-ene-3,20-dione is C21H29FO2.
What is the molecular weight of 15-Fluoropregn-4-ene-3,20-dione?
The molecular weight of 15-Fluoropregn-4-ene-3,20-dione is 332.22 g/mol.
Where can I buy 15-Fluoropregn-4-ene-3,20-dione?
You can request a quote for 15-Fluoropregn-4-ene-3,20-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 15-Fluoropregn-4-ene-3,20-dione?
Yes, KEHONG BIO provides custom synthesis services for 15-Fluoropregn-4-ene-3,20-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.