9-Chloro-6,11-difluoro-16-methyl-3,20-dioxopregna-1,4-dien-21-yl pentanoate
TL;DR: 9-Chloro-6,11-difluoro-16-methyl-3,20-dioxopregna-1,4-dien-21-yl pentanoate (CAS 24320-24-9) is a chemical compound with molecular formula C27H35ClF2O4 and molecular weight 496.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(9-chloro-6,11-difluoro-10,13,16-trimethyl-3-oxo-7,8,11,12,14,15,16,17-octahydro-6H-cyclopenta[a]phenanthren-17-yl)-2-oxoethyl] pentanoate
Also Known As: 9-chloro-6,11-difluoro-16-methyl-3,20-dioxopregna-1,4-dien-21-yl pentanoate, [2-(9-chloro-6,11-difluoro-10,13,16-trimethyl-3-oxo-7,8,11,12,14,15,16,17-octahydro-6H-cyclopenta[a]phenanthren-17-yl)-2-oxoethyl] pentanoate, 9-Chloro-6alpha,11beta-difluoro-21-hydroxy-16alpha-methylpregna-1,4-diene-3,20-dione 21-valerate
| Molecular Formula | C27H35ClF2O4 |
|---|---|
| Molecular Weight | 496.22 g/mol |
| LogP | 5.6 |
| Topological Polar Surface Area | 60.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 496.2192 |
| Heavy Atoms | 34 |
| Complexity | 947.0 |
Chemical Identifiers
| CAS Number | 24320-24-9 |
|---|---|
| SMILES | CCCCC(=O)OCC(=O)C1C(CC2C1(CC(C3(C2CC(C4=CC(=O)C=CC43C)F)Cl)F)C)C |
| InChIKey | ZQNXBAZRKNDZQZ-UHFFFAOYSA-N |
Product Overview
9-Chloro-6,11-difluoro-16-methyl-3,20-dioxopregna-1,4-dien-21-yl pentanoate (CAS 24320-24-9), with molecular formula C27H35ClF2O4 and molecular weight 496.22 g/mol. IUPAC: [2-(9-chloro-6,11-difluoro-10,13,16-trimethyl-3-oxo-7,8,11,12,14,15,16,17-octahydro-6H-cyclopenta[a]phenanthren-17-yl)-2-oxoethyl] pentanoate.
Chemical Property Profile of 9-Chloro-6,11-difluoro-16-methyl-3,20-dioxopregna-1,4-dien-21-yl pentanoate
Property Insights of 9-Chloro-6,11-difluoro-16-methyl-3,20-dioxopregna-1,4-dien-21-yl pentanoate
The XLogP value of 5.6 indicates that 9-Chloro-6,11-difluoro-16-methyl-3,20-dioxopregna-1,4-dien-21-yl pentanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 9-Chloro-6,11-difluoro-16-methyl-3,20-dioxopregna-1,4-dien-21-yl pentanoate. Following Lipinski's Rule of Five, 9-Chloro-6,11-difluoro-16-methyl-3,20-dioxopregna-1,4-dien-21-yl pentanoate has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 9-Chloro-6,11-difluoro-16-methyl-3,20-dioxopregna-1,4-dien-21-yl pentanoate?
The CAS number of 9-Chloro-6,11-difluoro-16-methyl-3,20-dioxopregna-1,4-dien-21-yl pentanoate is 24320-24-9.
What is the molecular formula of 9-Chloro-6,11-difluoro-16-methyl-3,20-dioxopregna-1,4-dien-21-yl pentanoate?
The molecular formula of 9-Chloro-6,11-difluoro-16-methyl-3,20-dioxopregna-1,4-dien-21-yl pentanoate is C27H35ClF2O4.
What is the molecular weight of 9-Chloro-6,11-difluoro-16-methyl-3,20-dioxopregna-1,4-dien-21-yl pentanoate?
The molecular weight of 9-Chloro-6,11-difluoro-16-methyl-3,20-dioxopregna-1,4-dien-21-yl pentanoate is 496.22 g/mol.
Where can I buy 9-Chloro-6,11-difluoro-16-methyl-3,20-dioxopregna-1,4-dien-21-yl pentanoate?
You can request a quote for 9-Chloro-6,11-difluoro-16-methyl-3,20-dioxopregna-1,4-dien-21-yl pentanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9-Chloro-6,11-difluoro-16-methyl-3,20-dioxopregna-1,4-dien-21-yl pentanoate?
Yes, KEHONG BIO provides custom synthesis services for 9-Chloro-6,11-difluoro-16-methyl-3,20-dioxopregna-1,4-dien-21-yl pentanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.