N-[4-cyano-5-(4-fluoro-3-methylanilino)-1H-pyrazol-3-yl]-3-methylbenzenesulfonamide
TL;DR: N-[4-cyano-5-(4-fluoro-3-methylanilino)-1H-pyrazol-3-yl]-3-methylbenzenesulfonamide (CAS 1024018-93-6) is a chemical compound with molecular formula C18H16FN5O2S and molecular weight 385.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-cyano-5-(4-fluoro-3-methylanilino)-1H-pyrazol-3-yl]-3-methylbenzenesulfonamide
Also Known As: N-[4-cyano-5-(4-fluoro-3-methylanilino)-1H-pyrazol-3-yl]-3-methylbenzenesulfonamide, N-{4-cyano-3-[(4-fluoro-3-methylphenyl)amino]-1H-pyrazol-5-yl}-3-methylbenzene-1-sulfonamide, N-[4-cyano-3-(4-fluoro-3-methylanilino)-1H-pyrazol-5-yl]-3-methylbenzenesulfonamide, N-{4-cyano-5-[(4-fluoro-3-methylphenyl)amino]-2H-pyrazol-3-yl}-3-methylbenzenesulfonamide, N-[4-cyano-5-[(4-fluoro-3-methyl-phenyl)amino]-1H-pyrazol-3-yl]-3-methyl-benzenesulfonamide
| Molecular Formula | C18H16FN5O2S |
|---|---|
| Molecular Weight | 385.10 g/mol |
| LogP | 3.58172 |
| Topological Polar Surface Area | 110.67 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 385.10086 |
| Heavy Atoms | 27 |
| Complexity | 1148.799 |
Chemical Identifiers
| CAS Number | 1024018-93-6 |
|---|---|
| SMILES | CC1=CC(=CC=C1)S(=O)(=O)NC2=NNC(=C2C#N)NC3=CC(=C(C=C3)F)C |
Product Overview
N-[4-cyano-5-(4-fluoro-3-methylanilino)-1H-pyrazol-3-yl]-3-methylbenzenesulfonamide (CAS 1024018-93-6), with molecular formula C18H16FN5O2S and molecular weight 385.10 g/mol. IUPAC: N-[4-cyano-5-(4-fluoro-3-methylanilino)-1H-pyrazol-3-yl]-3-methylbenzenesulfonamide.
Chemical Property Profile of N-[4-cyano-5-(4-fluoro-3-methylanilino)-1H-pyrazol-3-yl]-3-methylbenzenesulfonamide
Property Insights of N-[4-cyano-5-(4-fluoro-3-methylanilino)-1H-pyrazol-3-yl]-3-methylbenzenesulfonamide
The XLogP value of 3.58172 indicates that N-[4-cyano-5-(4-fluoro-3-methylanilino)-1H-pyrazol-3-yl]-3-methylbenzenesulfonamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 110.67 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[4-cyano-5-(4-fluoro-3-methylanilino)-1H-pyrazol-3-yl]-3-methylbenzenesulfonamide. Following Lipinski's Rule of Five, N-[4-cyano-5-(4-fluoro-3-methylanilino)-1H-pyrazol-3-yl]-3-methylbenzenesulfonamide has 3 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 N-[4-cyano-5-(4-fluoro-3-methylanilino)-1H-pyrazol-3-yl]-3-methylbenzenesulfonamide?
The CAS number of N-[4-cyano-5-(4-fluoro-3-methylanilino)-1H-pyrazol-3-yl]-3-methylbenzenesulfonamide is 1024018-93-6.
What is the molecular formula of N-[4-cyano-5-(4-fluoro-3-methylanilino)-1H-pyrazol-3-yl]-3-methylbenzenesulfonamide?
The molecular formula of N-[4-cyano-5-(4-fluoro-3-methylanilino)-1H-pyrazol-3-yl]-3-methylbenzenesulfonamide is C18H16FN5O2S.
What is the molecular weight of N-[4-cyano-5-(4-fluoro-3-methylanilino)-1H-pyrazol-3-yl]-3-methylbenzenesulfonamide?
The molecular weight of N-[4-cyano-5-(4-fluoro-3-methylanilino)-1H-pyrazol-3-yl]-3-methylbenzenesulfonamide is 385.10 g/mol.
Where can I buy N-[4-cyano-5-(4-fluoro-3-methylanilino)-1H-pyrazol-3-yl]-3-methylbenzenesulfonamide?
You can request a quote for N-[4-cyano-5-(4-fluoro-3-methylanilino)-1H-pyrazol-3-yl]-3-methylbenzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[4-cyano-5-(4-fluoro-3-methylanilino)-1H-pyrazol-3-yl]-3-methylbenzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for N-[4-cyano-5-(4-fluoro-3-methylanilino)-1H-pyrazol-3-yl]-3-methylbenzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.