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N4-[3,5-di(trifluoromethyl)phenyl]-5-chloro-1,3-dimethyl-1H-pyrazole-4-sulphonamide
TL;DR: N4-[3,5-di(trifluoromethyl)phenyl]-5-chloro-1,3-dimethyl-1H-pyrazole-4-sulphonamide (CAS 647825-46-5) is a chemical compound with molecular formula C13H10ClF6N3O2S and molecular weight 421.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[3,5-bis(trifluoromethyl)phenyl]-5-chloro-1,3-dimethylpyrazole-4-sulfonamide
Also Known As: N4-[3,5-di(trifluoromethyl)phenyl]-5-chloro-1,3-dimethyl-1H-pyrazole-4-sulphonamide, N-[3,5-bis(trifluoromethyl)phenyl]-5-chloro-1,3-dimethylpyrazole-4-sulfonamide, N4-[3,5-DI(TRIFLUOROMETHYL)PHENYL]-5-CHLORO-1,3-DIMETHYL-1H-PYRAZOLE-4-SULFONAMIDE
| Molecular Formula | C13H10ClF6N3O2S |
|---|---|
| Molecular Weight | 421.01 g/mol |
| LogP | 4.22032 |
| Topological Polar Surface Area | 63.99 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 421.00864 |
| Heavy Atoms | 26 |
| Complexity | 917.7597 |
Chemical Identifiers
| CAS Number | 647825-46-5 |
|---|---|
| SMILES | CC1=NN(C(=C1S(=O)(=O)NC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)Cl)C |
Product Overview
N4-[3,5-di(trifluoromethyl)phenyl]-5-chloro-1,3-dimethyl-1H-pyrazole-4-sulphonamide (CAS 647825-46-5), with molecular formula C13H10ClF6N3O2S and molecular weight 421.01 g/mol. IUPAC: N-[3,5-bis(trifluoromethyl)phenyl]-5-chloro-1,3-dimethylpyrazole-4-sulfonamide.
Chemical Property Profile of N4-[3,5-di(trifluoromethyl)phenyl]-5-chloro-1,3-dimethyl-1H-pyrazole-4-sulphonamide
Property Insights of N4-[3,5-di(trifluoromethyl)phenyl]-5-chloro-1,3-dimethyl-1H-pyrazole-4-sulphonamide
The XLogP value of 4.22032 indicates that N4-[3,5-di(trifluoromethyl)phenyl]-5-chloro-1,3-dimethyl-1H-pyrazole-4-sulphonamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.99 Ų falls within the moderate polarity range, balancing permeability and solubility for N4-[3,5-di(trifluoromethyl)phenyl]-5-chloro-1,3-dimethyl-1H-pyrazole-4-sulphonamide. Following Lipinski's Rule of Five, N4-[3,5-di(trifluoromethyl)phenyl]-5-chloro-1,3-dimethyl-1H-pyrazole-4-sulphonamide 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 N4-[3,5-di(trifluoromethyl)phenyl]-5-chloro-1,3-dimethyl-1H-pyrazole-4-sulphonamide?
The CAS number of N4-[3,5-di(trifluoromethyl)phenyl]-5-chloro-1,3-dimethyl-1H-pyrazole-4-sulphonamide is 647825-46-5.
What is the molecular formula of N4-[3,5-di(trifluoromethyl)phenyl]-5-chloro-1,3-dimethyl-1H-pyrazole-4-sulphonamide?
The molecular formula of N4-[3,5-di(trifluoromethyl)phenyl]-5-chloro-1,3-dimethyl-1H-pyrazole-4-sulphonamide is C13H10ClF6N3O2S.
What is the molecular weight of N4-[3,5-di(trifluoromethyl)phenyl]-5-chloro-1,3-dimethyl-1H-pyrazole-4-sulphonamide?
The molecular weight of N4-[3,5-di(trifluoromethyl)phenyl]-5-chloro-1,3-dimethyl-1H-pyrazole-4-sulphonamide is 421.01 g/mol.
Where can I buy N4-[3,5-di(trifluoromethyl)phenyl]-5-chloro-1,3-dimethyl-1H-pyrazole-4-sulphonamide?
You can request a quote for N4-[3,5-di(trifluoromethyl)phenyl]-5-chloro-1,3-dimethyl-1H-pyrazole-4-sulphonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N4-[3,5-di(trifluoromethyl)phenyl]-5-chloro-1,3-dimethyl-1H-pyrazole-4-sulphonamide?
Yes, KEHONG BIO provides custom synthesis services for N4-[3,5-di(trifluoromethyl)phenyl]-5-chloro-1,3-dimethyl-1H-pyrazole-4-sulphonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.