Tipredane
TL;DR: Tipredane (CAS 85197-77-9) is a chemical compound with molecular formula C22H31FO2S2 and molecular weight 410.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(8S,9R,10S,11S,13S,14S,17R)-17-ethylsulfanyl-9-fluoro-11-hydroxy-10,13-dimethyl-17-methylsulfanyl-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-3-one
Also Known As: TIPREDANE, Tipredano, Tipredanum, Uoderm, Tipredanum [Latin]
| Molecular Formula | C22H31FO2S2 |
|---|---|
| Molecular Weight | 410.17 g/mol |
| LogP | 5.1696 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 410.17496 |
| Heavy Atoms | 27 |
| Complexity | 721.1013 |
Chemical Identifiers
| CAS Number | 85197-77-9 |
|---|---|
| SMILES | CCS[C@@]1(CC[C@@H]2[C@@]1(C[C@@H]([C@]3([C@H]2CCC4=CC(=O)C=C[C@@]43C)F)O)C)SC |
Product Overview
Tipredane (CAS 85197-77-9), with molecular formula C22H31FO2S2 and molecular weight 410.17 g/mol. IUPAC: (8S,9R,10S,11S,13S,14S,17R)-17-ethylsulfanyl-9-fluoro-11-hydroxy-10,13-dimethyl-17-methylsulfanyl-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-3-one.
Chemical Property Profile of Tipredane
Property Insights of Tipredane
The XLogP value of 5.1696 indicates that Tipredane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, Tipredane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Tipredane has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Tipredane?
The CAS number of Tipredane is 85197-77-9.
What is the molecular formula of Tipredane?
The molecular formula of Tipredane is C22H31FO2S2.
What is the molecular weight of Tipredane?
The molecular weight of Tipredane is 410.17 g/mol.
Where can I buy Tipredane?
You can request a quote for Tipredane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tipredane?
Yes, KEHONG BIO provides custom synthesis services for Tipredane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.