4-(2,2,5,5-Tetramethylpyrrolidine-1-oxyl)-4-fluorosulfonylbenzamide
TL;DR: 4-(2,2,5,5-Tetramethylpyrrolidine-1-oxyl)-4-fluorosulfonylbenzamide (CAS 52413-50-0) is a chemical compound with molecular formula C15H20FN2O4S and molecular weight 343.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
Also Known As: 4-Tempo-fsb, 4-(2,2,5,5-Tetramethylpyrrolidine-1-oxyl)-4-fluorosulfonylbenzamide, J1.425.407B, 8-chloro-2-pyridin-2-ylquinoline-4-carboxylic acid, {3-[4-(Fluorosulfonyl)benzamido]-2,2,5,5-tetramethylpyrrolidin-1-yl}oxidanyl
| Molecular Formula | C15H20FN2O4S |
|---|---|
| Molecular Weight | 343.11 g/mol |
| LogP | 2.0516 |
| Topological Polar Surface Area | 86.38 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 343.1128 |
| Heavy Atoms | 23 |
| Complexity | 713.4974 |
Chemical Identifiers
| CAS Number | 52413-50-0 |
|---|---|
| SMILES | CC1(CC(C(N1[O])(C)C)NC(=O)C2=CC=C(C=C2)S(=O)(=O)F)C |
Product Overview
4-(2,2,5,5-Tetramethylpyrrolidine-1-oxyl)-4-fluorosulfonylbenzamide (CAS 52413-50-0), with molecular formula C15H20FN2O4S and molecular weight 343.11 g/mol.
Chemical Property Profile of 4-(2,2,5,5-Tetramethylpyrrolidine-1-oxyl)-4-fluorosulfonylbenzamide
Property Insights of 4-(2,2,5,5-Tetramethylpyrrolidine-1-oxyl)-4-fluorosulfonylbenzamide
The XLogP value of 2.0516 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(2,2,5,5-Tetramethylpyrrolidine-1-oxyl)-4-fluorosulfonylbenzamide. The TPSA of 86.38 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(2,2,5,5-Tetramethylpyrrolidine-1-oxyl)-4-fluorosulfonylbenzamide. Following Lipinski's Rule of Five, 4-(2,2,5,5-Tetramethylpyrrolidine-1-oxyl)-4-fluorosulfonylbenzamide has 1 hydrogen bond donor(s) and 4 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-(2,2,5,5-Tetramethylpyrrolidine-1-oxyl)-4-fluorosulfonylbenzamide?
The CAS number of 4-(2,2,5,5-Tetramethylpyrrolidine-1-oxyl)-4-fluorosulfonylbenzamide is 52413-50-0.
What is the molecular formula of 4-(2,2,5,5-Tetramethylpyrrolidine-1-oxyl)-4-fluorosulfonylbenzamide?
The molecular formula of 4-(2,2,5,5-Tetramethylpyrrolidine-1-oxyl)-4-fluorosulfonylbenzamide is C15H20FN2O4S.
What is the molecular weight of 4-(2,2,5,5-Tetramethylpyrrolidine-1-oxyl)-4-fluorosulfonylbenzamide?
The molecular weight of 4-(2,2,5,5-Tetramethylpyrrolidine-1-oxyl)-4-fluorosulfonylbenzamide is 343.11 g/mol.
Where can I buy 4-(2,2,5,5-Tetramethylpyrrolidine-1-oxyl)-4-fluorosulfonylbenzamide?
You can request a quote for 4-(2,2,5,5-Tetramethylpyrrolidine-1-oxyl)-4-fluorosulfonylbenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(2,2,5,5-Tetramethylpyrrolidine-1-oxyl)-4-fluorosulfonylbenzamide?
Yes, KEHONG BIO provides custom synthesis services for 4-(2,2,5,5-Tetramethylpyrrolidine-1-oxyl)-4-fluorosulfonylbenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.