RefChem:435750
TL;DR: RefChem:435750 (CAS 845674-84-2) is a chemical compound with molecular formula C16H11BrF3N3O2S and molecular weight 444.97073 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
RefChem:435750
4-[5-(4-bromophenyl)-3-(trifluoromethyl)pyrazol-1-yl]benzenesulfonamide
Also Known As: 1,6-Bis(trichlorosilyl)hexane, 1-phenylsulfonamide-3-trifluoromethyl-5-parabromophenylpyrazole, SC 558, 4-[5-(4-bromophenyl)-3-(trifluoromethyl)pyrazol-1-yl]benzenesulfonamide, 4-(5-(4-bromophenyl)-3-(trifluoromethyl)-1H-pyrazol-1-yl)benzenesulfonamide
Application Areas
Top 5 of 5 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C16H11BrF3N3O2S |
| Molecular Weight | 444.97073 g/mol |
| XLogP | 3.7 |
| Topological Polar Surface Area (TPSA) | 86.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 444.97073 Da |
| Heavy Atoms | 26 |
| Complexity | 583.0 |
| SMILES | C1=CC(=CC=C1C2=CC(=NN2C3=CC=C(C=C3)S(=O)(=O)N)C(F)(F)F)Br |
| InChIKey | OYZKFVIVPRQRQQ-UHFFFAOYSA-N |
Chemical Property Profile of RefChem:435750
Property Insights of RefChem:435750
The XLogP value of 3.7 indicates that RefChem:435750 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.4 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:435750. Following Lipinski's Rule of Five, RefChem:435750 has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of RefChem:435750?
The CAS number of RefChem:435750 is 845674-84-2.
What is the molecular formula of RefChem:435750?
The molecular formula of RefChem:435750 is C16H11BrF3N3O2S.
What is the molecular weight of RefChem:435750?
The molecular weight of RefChem:435750 is 444.97073 g/mol.
Where can I buy RefChem:435750?
You can request a quote for RefChem:435750 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:435750?
Yes, CoreyChem provides custom synthesis services for RefChem:435750 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.