alpha-(2-Piperidyl)-3,6-bis(trifluoromethyl)-9-phenanthrenemethanol
TL;DR: alpha-(2-Piperidyl)-3,6-bis(trifluoromethyl)-9-phenanthrenemethanol (CAS 36855-74-0) is a chemical compound with molecular formula C22H19F6NO and molecular weight 427.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3,6-bis(trifluoromethyl)phenanthren-9-yl]-piperidin-2-ylmethanol
Also Known As: KST-1A4289, KST-1A4290, NCI60_000889, WR 122455, N-(2,3,5,6-Tetramethylbenzoyl)adenine
| Molecular Formula | C22H19F6NO |
|---|---|
| Molecular Weight | 427.14 g/mol |
| LogP | 5.8 |
| Topological Polar Surface Area | 32.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 2 |
| Exact Mass | 427.1371 |
| Heavy Atoms | 30 |
| Complexity | 593.0 |
Chemical Identifiers
| CAS Number | 36855-74-0 |
|---|---|
| SMILES | C1CCNC(C1)C(C2=C3C=CC(=CC3=C4C=C(C=CC4=C2)C(F)(F)F)C(F)(F)F)O |
| InChIKey | FVVWTCZWVDUHPH-UHFFFAOYSA-N |
Product Overview
alpha-(2-Piperidyl)-3,6-bis(trifluoromethyl)-9-phenanthrenemethanol (CAS 36855-74-0), with molecular formula C22H19F6NO and molecular weight 427.14 g/mol. IUPAC: [3,6-bis(trifluoromethyl)phenanthren-9-yl]-piperidin-2-ylmethanol.
Chemical Property Profile of alpha-(2-Piperidyl)-3,6-bis(trifluoromethyl)-9-phenanthrenemethanol
Property Insights of alpha-(2-Piperidyl)-3,6-bis(trifluoromethyl)-9-phenanthrenemethanol
The XLogP value of 5.8 indicates that alpha-(2-Piperidyl)-3,6-bis(trifluoromethyl)-9-phenanthrenemethanol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.3 Ų, alpha-(2-Piperidyl)-3,6-bis(trifluoromethyl)-9-phenanthrenemethanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, alpha-(2-Piperidyl)-3,6-bis(trifluoromethyl)-9-phenanthrenemethanol has 2 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of alpha-(2-Piperidyl)-3,6-bis(trifluoromethyl)-9-phenanthrenemethanol?
The CAS number of alpha-(2-Piperidyl)-3,6-bis(trifluoromethyl)-9-phenanthrenemethanol is 36855-74-0.
What is the molecular formula of alpha-(2-Piperidyl)-3,6-bis(trifluoromethyl)-9-phenanthrenemethanol?
The molecular formula of alpha-(2-Piperidyl)-3,6-bis(trifluoromethyl)-9-phenanthrenemethanol is C22H19F6NO.
What is the molecular weight of alpha-(2-Piperidyl)-3,6-bis(trifluoromethyl)-9-phenanthrenemethanol?
The molecular weight of alpha-(2-Piperidyl)-3,6-bis(trifluoromethyl)-9-phenanthrenemethanol is 427.14 g/mol.
Where can I buy alpha-(2-Piperidyl)-3,6-bis(trifluoromethyl)-9-phenanthrenemethanol?
You can request a quote for alpha-(2-Piperidyl)-3,6-bis(trifluoromethyl)-9-phenanthrenemethanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for alpha-(2-Piperidyl)-3,6-bis(trifluoromethyl)-9-phenanthrenemethanol?
Yes, KEHONG BIO provides custom synthesis services for alpha-(2-Piperidyl)-3,6-bis(trifluoromethyl)-9-phenanthrenemethanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.