![5-[2-(trifluoromethyl)phenyl]-2,3,5,6-tetrahydro-1H-benzo[a]phenanthridin-4-one structure](/static/products/3337/333759-59-4.webp)
5-[2-(trifluoromethyl)phenyl]-2,3,5,6-tetrahydro-1H-benzo[a]phenanthridin-4-one
TL;DR: 5-[2-(trifluoromethyl)phenyl]-2,3,5,6-tetrahydro-1H-benzo[a]phenanthridin-4-one (CAS 333759-59-4) is a chemical compound with molecular formula C24H18F3NO and molecular weight 393.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[2-(trifluoromethyl)phenyl]-2,3,5,6-tetrahydro-1H-benzo[a]phenanthridin-4-one
Also Known As: BAS 00918320, 5-[2-(trifluoromethyl)phenyl]-2,3,5,6-tetrahydro-1H-benzo[a]phenanthridin-4-one, 5-[2-(trifluoromethyl)phenyl]-2,3,5,6-tetrahydrobenzo[a]phenanthridin-4(1H)-one, 5-(2-Trifluoromethyl-phenyl)-2,3,5,6-tetrahydro-1H-benzo[a]phenanthridin-4-one, 5-[2-(trifluoromethyl)phenyl]-1,2,3,5,6-pentahydrobenzo[a]phenanthridin-4-one
| Molecular Formula | C24H18F3NO |
|---|---|
| Molecular Weight | 393.13 g/mol |
| LogP | 6.532 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 393.13406 |
| Heavy Atoms | 29 |
| Complexity | 1176.2045 |
Chemical Identifiers
| CAS Number | 333759-59-4 |
|---|---|
| SMILES | C1CC2=C(C(NC3=C2C4=CC=CC=C4C=C3)C5=CC=CC=C5C(F)(F)F)C(=O)C1 |
Product Overview
5-[2-(trifluoromethyl)phenyl]-2,3,5,6-tetrahydro-1H-benzo[a]phenanthridin-4-one (CAS 333759-59-4), with molecular formula C24H18F3NO and molecular weight 393.13 g/mol. IUPAC: 5-[2-(trifluoromethyl)phenyl]-2,3,5,6-tetrahydro-1H-benzo[a]phenanthridin-4-one.
Chemical Property Profile of 5-[2-(trifluoromethyl)phenyl]-2,3,5,6-tetrahydro-1H-benzo[a]phenanthridin-4-one
Property Insights of 5-[2-(trifluoromethyl)phenyl]-2,3,5,6-tetrahydro-1H-benzo[a]phenanthridin-4-one
The XLogP value of 6.532 indicates that 5-[2-(trifluoromethyl)phenyl]-2,3,5,6-tetrahydro-1H-benzo[a]phenanthridin-4-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.1 Ų, 5-[2-(trifluoromethyl)phenyl]-2,3,5,6-tetrahydro-1H-benzo[a]phenanthridin-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-[2-(trifluoromethyl)phenyl]-2,3,5,6-tetrahydro-1H-benzo[a]phenanthridin-4-one has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5-[2-(trifluoromethyl)phenyl]-2,3,5,6-tetrahydro-1H-benzo[a]phenanthridin-4-one?
The CAS number of 5-[2-(trifluoromethyl)phenyl]-2,3,5,6-tetrahydro-1H-benzo[a]phenanthridin-4-one is 333759-59-4.
What is the molecular formula of 5-[2-(trifluoromethyl)phenyl]-2,3,5,6-tetrahydro-1H-benzo[a]phenanthridin-4-one?
The molecular formula of 5-[2-(trifluoromethyl)phenyl]-2,3,5,6-tetrahydro-1H-benzo[a]phenanthridin-4-one is C24H18F3NO.
What is the molecular weight of 5-[2-(trifluoromethyl)phenyl]-2,3,5,6-tetrahydro-1H-benzo[a]phenanthridin-4-one?
The molecular weight of 5-[2-(trifluoromethyl)phenyl]-2,3,5,6-tetrahydro-1H-benzo[a]phenanthridin-4-one is 393.13 g/mol.
Where can I buy 5-[2-(trifluoromethyl)phenyl]-2,3,5,6-tetrahydro-1H-benzo[a]phenanthridin-4-one?
You can request a quote for 5-[2-(trifluoromethyl)phenyl]-2,3,5,6-tetrahydro-1H-benzo[a]phenanthridin-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-[2-(trifluoromethyl)phenyl]-2,3,5,6-tetrahydro-1H-benzo[a]phenanthridin-4-one?
Yes, KEHONG BIO provides custom synthesis services for 5-[2-(trifluoromethyl)phenyl]-2,3,5,6-tetrahydro-1H-benzo[a]phenanthridin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.