Testiphenon
TL;DR: Testiphenon (CAS 104730-58-7) is a chemical compound with molecular formula C31H43Cl2NO3 and molecular weight 547.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(5S,8R,9S,10S,13S,14S,17S)-10,13-dimethyl-3-oxo-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl] 2-[4-[bis(2-chloroethyl)amino]phenyl]acetate
Also Known As: Testiphenon, Testiphenone, Acetic acid (S)-1-cyano-2-o-tolyloxy-ethyl ester, (5-alpha,17-beta)-17-(((4-(Bis(2-chloroethyl)amino)phenyl)acetyl)oxy)androstan-3-one, (5alpha,17beta)-17-(((4-(Bis(2-chloroethyl)amino)phenyl)acetyl)oxy)androstan-3-one
| Molecular Formula | C31H43Cl2NO3 |
|---|---|
| Molecular Weight | 547.26 g/mol |
| LogP | 7.1 |
| Topological Polar Surface Area | 46.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 547.262 |
| Heavy Atoms | 37 |
| Complexity | 823.0 |
Chemical Identifiers
| CAS Number | 104730-58-7 |
|---|---|
| SMILES | C[C@]12CCC(=O)C[C@@H]1CC[C@@H]3[C@@H]2CC[C@]4([C@H]3CC[C@@H]4OC(=O)CC5=CC=C(C=C5)N(CCCl)CCCl)C |
| InChIKey | JWLXQUMDRGJLMS-SJQIPMMSSA-N |
Product Overview
Testiphenon (CAS 104730-58-7), with molecular formula C31H43Cl2NO3 and molecular weight 547.26 g/mol. IUPAC: [(5S,8R,9S,10S,13S,14S,17S)-10,13-dimethyl-3-oxo-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl] 2-[4-[bis(2-chloroethyl)amino]phenyl]acetate.
Chemical Property Profile of Testiphenon
Property Insights of Testiphenon
The XLogP value of 7.1 indicates that Testiphenon is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.6 Ų, Testiphenon exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Testiphenon has 0 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 Testiphenon?
The CAS number of Testiphenon is 104730-58-7.
What is the molecular formula of Testiphenon?
The molecular formula of Testiphenon is C31H43Cl2NO3.
What is the molecular weight of Testiphenon?
The molecular weight of Testiphenon is 547.26 g/mol.
Where can I buy Testiphenon?
You can request a quote for Testiphenon directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Testiphenon?
Yes, KEHONG BIO provides custom synthesis services for Testiphenon and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.