6-Phenyl-3-[3-(trifluoromethyl)anilino]-1,5,6,7-tetrahydroindazol-4-one
TL;DR: 6-Phenyl-3-[3-(trifluoromethyl)anilino]-1,5,6,7-tetrahydroindazol-4-one (CAS 1023537-97-4) is a chemical compound with molecular formula C20H16F3N3O and molecular weight 371.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-phenyl-3-[3-(trifluoromethyl)anilino]-1,5,6,7-tetrahydroindazol-4-one
Also Known As: 6-phenyl-3-[3-(trifluoromethyl)anilino]-1,5,6,7-tetrahydroindazol-4-one, 6-PHENYL-3-((3-(TRIFLUOROMETHYL)PHENYL)AMINO)-5,6,7-TRIHYDRO1H-INDAZOL-4-ONE, 6-phenyl-3-[[3-(trifluoromethyl)phenyl]amino]-1,5,6,7-tetrahydroindazol-4-one
| Molecular Formula | C20H16F3N3O |
|---|---|
| Molecular Weight | 371.12 g/mol |
| LogP | 5.0848 |
| Topological Polar Surface Area | 57.78 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 371.12454 |
| Heavy Atoms | 27 |
| Complexity | 979.6371 |
Chemical Identifiers
| CAS Number | 1023537-97-4 |
|---|---|
| SMILES | C1C(CC(=O)C2=C1NN=C2NC3=CC=CC(=C3)C(F)(F)F)C4=CC=CC=C4 |
Product Overview
6-Phenyl-3-[3-(trifluoromethyl)anilino]-1,5,6,7-tetrahydroindazol-4-one (CAS 1023537-97-4), with molecular formula C20H16F3N3O and molecular weight 371.12 g/mol. IUPAC: 6-phenyl-3-[3-(trifluoromethyl)anilino]-1,5,6,7-tetrahydroindazol-4-one.
Chemical Property Profile of 6-Phenyl-3-[3-(trifluoromethyl)anilino]-1,5,6,7-tetrahydroindazol-4-one
Property Insights of 6-Phenyl-3-[3-(trifluoromethyl)anilino]-1,5,6,7-tetrahydroindazol-4-one
The XLogP value of 5.0848 indicates that 6-Phenyl-3-[3-(trifluoromethyl)anilino]-1,5,6,7-tetrahydroindazol-4-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.78 Ų, 6-Phenyl-3-[3-(trifluoromethyl)anilino]-1,5,6,7-tetrahydroindazol-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Phenyl-3-[3-(trifluoromethyl)anilino]-1,5,6,7-tetrahydroindazol-4-one has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 6-Phenyl-3-[3-(trifluoromethyl)anilino]-1,5,6,7-tetrahydroindazol-4-one?
The CAS number of 6-Phenyl-3-[3-(trifluoromethyl)anilino]-1,5,6,7-tetrahydroindazol-4-one is 1023537-97-4.
What is the molecular formula of 6-Phenyl-3-[3-(trifluoromethyl)anilino]-1,5,6,7-tetrahydroindazol-4-one?
The molecular formula of 6-Phenyl-3-[3-(trifluoromethyl)anilino]-1,5,6,7-tetrahydroindazol-4-one is C20H16F3N3O.
What is the molecular weight of 6-Phenyl-3-[3-(trifluoromethyl)anilino]-1,5,6,7-tetrahydroindazol-4-one?
The molecular weight of 6-Phenyl-3-[3-(trifluoromethyl)anilino]-1,5,6,7-tetrahydroindazol-4-one is 371.12 g/mol.
Where can I buy 6-Phenyl-3-[3-(trifluoromethyl)anilino]-1,5,6,7-tetrahydroindazol-4-one?
You can request a quote for 6-Phenyl-3-[3-(trifluoromethyl)anilino]-1,5,6,7-tetrahydroindazol-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Phenyl-3-[3-(trifluoromethyl)anilino]-1,5,6,7-tetrahydroindazol-4-one?
Yes, KEHONG BIO provides custom synthesis services for 6-Phenyl-3-[3-(trifluoromethyl)anilino]-1,5,6,7-tetrahydroindazol-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.