![4-(4-hydroxyphenyl)-2-[3-(trifluoromethyl)phenyl]-1(2H)-phthalazinone structure](/static/products/4869/486994-81-4.webp)
4-(4-hydroxyphenyl)-2-[3-(trifluoromethyl)phenyl]-1(2H)-phthalazinone
TL;DR: 4-(4-hydroxyphenyl)-2-[3-(trifluoromethyl)phenyl]-1(2H)-phthalazinone (CAS 486994-81-4) is a chemical compound with molecular formula C21H13F3N2O2 and molecular weight 382.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-hydroxyphenyl)-2-[3-(trifluoromethyl)phenyl]phthalazin-1-one
Also Known As: AN-655/37437005, 4-(4-hydroxyphenyl)-2-[3-(trifluoromethyl)phenyl]-1(2H)-phthalazinone, 4-(4-oxocyclohexa-2,5-dien-1-ylidene)-2-[3-(trifluoromethyl)phenyl]-3H-phthalazin-1-one, 4-(4-hydroxyphenyl)-2-(3-(trifluoromethyl)phenyl)phthalazin-1(2H)-one, 4-(4-hydroxyphenyl)-2-[3-(trifluoromethyl)phenyl]phthalazin-1(2H)-one
| Molecular Formula | C21H13F3N2O2 |
|---|---|
| Molecular Weight | 382.09 g/mol |
| LogP | 4.7771 |
| Topological Polar Surface Area | 55.12 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 382.09293 |
| Heavy Atoms | 28 |
| Complexity | 1229.0753 |
Chemical Identifiers
| CAS Number | 486994-81-4 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=NN(C2=O)C3=CC=CC(=C3)C(F)(F)F)C4=CC=C(C=C4)O |
Product Overview
4-(4-hydroxyphenyl)-2-[3-(trifluoromethyl)phenyl]-1(2H)-phthalazinone (CAS 486994-81-4), with molecular formula C21H13F3N2O2 and molecular weight 382.09 g/mol. IUPAC: 4-(4-hydroxyphenyl)-2-[3-(trifluoromethyl)phenyl]phthalazin-1-one.
Chemical Property Profile of 4-(4-hydroxyphenyl)-2-[3-(trifluoromethyl)phenyl]-1(2H)-phthalazinone
Property Insights of 4-(4-hydroxyphenyl)-2-[3-(trifluoromethyl)phenyl]-1(2H)-phthalazinone
The XLogP value of 4.7771 indicates that 4-(4-hydroxyphenyl)-2-[3-(trifluoromethyl)phenyl]-1(2H)-phthalazinone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.12 Ų, 4-(4-hydroxyphenyl)-2-[3-(trifluoromethyl)phenyl]-1(2H)-phthalazinone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(4-hydroxyphenyl)-2-[3-(trifluoromethyl)phenyl]-1(2H)-phthalazinone has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-(4-hydroxyphenyl)-2-[3-(trifluoromethyl)phenyl]-1(2H)-phthalazinone?
The CAS number of 4-(4-hydroxyphenyl)-2-[3-(trifluoromethyl)phenyl]-1(2H)-phthalazinone is 486994-81-4.
What is the molecular formula of 4-(4-hydroxyphenyl)-2-[3-(trifluoromethyl)phenyl]-1(2H)-phthalazinone?
The molecular formula of 4-(4-hydroxyphenyl)-2-[3-(trifluoromethyl)phenyl]-1(2H)-phthalazinone is C21H13F3N2O2.
What is the molecular weight of 4-(4-hydroxyphenyl)-2-[3-(trifluoromethyl)phenyl]-1(2H)-phthalazinone?
The molecular weight of 4-(4-hydroxyphenyl)-2-[3-(trifluoromethyl)phenyl]-1(2H)-phthalazinone is 382.09 g/mol.
Where can I buy 4-(4-hydroxyphenyl)-2-[3-(trifluoromethyl)phenyl]-1(2H)-phthalazinone?
You can request a quote for 4-(4-hydroxyphenyl)-2-[3-(trifluoromethyl)phenyl]-1(2H)-phthalazinone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(4-hydroxyphenyl)-2-[3-(trifluoromethyl)phenyl]-1(2H)-phthalazinone?
Yes, KEHONG BIO provides custom synthesis services for 4-(4-hydroxyphenyl)-2-[3-(trifluoromethyl)phenyl]-1(2H)-phthalazinone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.