5-{4-[(4-Fluorophenyl)amino]phthalazin-1-yl}-2-methylbenzenesulfonamide
TL;DR: 5-{4-[(4-Fluorophenyl)amino]phthalazin-1-yl}-2-methylbenzenesulfonamide (CAS 371119-52-7) is a chemical compound with molecular formula C21H17FN4O2S and molecular weight 408.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[4-(4-fluoroanilino)phthalazin-1-yl]-2-methylbenzenesulfonamide
Also Known As: BAS 04375894, 5-{4-[(4-fluorophenyl)amino]phthalazin-1-yl}-2-methylbenzenesulfonamide, 5-[4-(4-fluoroanilino)phthalazin-1-yl]-2-methylbenzenesulfonamide, 5-(4-((4-fluorophenyl)amino)phthalazin-1-yl)-2-methylbenzenesulfonamide, 5-[4-(4-Fluoro-phenylamino)-phthalazin-1-yl]-2-methyl-benzenesulfonamide
| Molecular Formula | C21H17FN4O2S |
|---|---|
| Molecular Weight | 408.11 g/mol |
| LogP | 4.13532 |
| Topological Polar Surface Area | 97.97 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 408.10562 |
| Heavy Atoms | 29 |
| Complexity | 1322.6001 |
Chemical Identifiers
| CAS Number | 371119-52-7 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)C2=NN=C(C3=CC=CC=C32)NC4=CC=C(C=C4)F)S(=O)(=O)N |
Product Overview
5-{4-[(4-Fluorophenyl)amino]phthalazin-1-yl}-2-methylbenzenesulfonamide (CAS 371119-52-7), with molecular formula C21H17FN4O2S and molecular weight 408.11 g/mol. IUPAC: 5-[4-(4-fluoroanilino)phthalazin-1-yl]-2-methylbenzenesulfonamide.
Chemical Property Profile of 5-{4-[(4-Fluorophenyl)amino]phthalazin-1-yl}-2-methylbenzenesulfonamide
Property Insights of 5-{4-[(4-Fluorophenyl)amino]phthalazin-1-yl}-2-methylbenzenesulfonamide
The XLogP value of 4.13532 indicates that 5-{4-[(4-Fluorophenyl)amino]phthalazin-1-yl}-2-methylbenzenesulfonamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 97.97 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-{4-[(4-Fluorophenyl)amino]phthalazin-1-yl}-2-methylbenzenesulfonamide. Following Lipinski's Rule of Five, 5-{4-[(4-Fluorophenyl)amino]phthalazin-1-yl}-2-methylbenzenesulfonamide has 2 hydrogen bond donor(s) and 5 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 5-{4-[(4-Fluorophenyl)amino]phthalazin-1-yl}-2-methylbenzenesulfonamide?
The CAS number of 5-{4-[(4-Fluorophenyl)amino]phthalazin-1-yl}-2-methylbenzenesulfonamide is 371119-52-7.
What is the molecular formula of 5-{4-[(4-Fluorophenyl)amino]phthalazin-1-yl}-2-methylbenzenesulfonamide?
The molecular formula of 5-{4-[(4-Fluorophenyl)amino]phthalazin-1-yl}-2-methylbenzenesulfonamide is C21H17FN4O2S.
What is the molecular weight of 5-{4-[(4-Fluorophenyl)amino]phthalazin-1-yl}-2-methylbenzenesulfonamide?
The molecular weight of 5-{4-[(4-Fluorophenyl)amino]phthalazin-1-yl}-2-methylbenzenesulfonamide is 408.11 g/mol.
Where can I buy 5-{4-[(4-Fluorophenyl)amino]phthalazin-1-yl}-2-methylbenzenesulfonamide?
You can request a quote for 5-{4-[(4-Fluorophenyl)amino]phthalazin-1-yl}-2-methylbenzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-{4-[(4-Fluorophenyl)amino]phthalazin-1-yl}-2-methylbenzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for 5-{4-[(4-Fluorophenyl)amino]phthalazin-1-yl}-2-methylbenzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.