N-(4,6-dimethylpyrimidin-2-yl)-4-fluorobenzenesulfonamide
TL;DR: N-(4,6-dimethylpyrimidin-2-yl)-4-fluorobenzenesulfonamide (CAS 312-55-0) is a chemical compound with molecular formula C12H12FN3O2S and molecular weight 281.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4,6-dimethylpyrimidin-2-yl)-4-fluorobenzenesulfonamide
Also Known As: BAS 03032598, N-(4,6-dimethylpyrimidin-2-yl)-4-fluorobenzenesulfonamide, (4,6-dimethylpyrimidin-2-yl)[(4-fluorophenyl)sulfonyl]amine, N-(4,6-Dimethyl-pyrimidin-2-yl)-4-fluoro-benzenesulfonamide, N-(4,6-dimethylpyrimidin-2-yl)-4-fluorobenzene-1-sulfonamide
| Molecular Formula | C12H12FN3O2S |
|---|---|
| Molecular Weight | 281.06 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 80.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 281.06342 |
| Heavy Atoms | 19 |
| Complexity | 380.0 |
Chemical Identifiers
| CAS Number | 312-55-0 |
|---|---|
| SMILES | CC1=CC(=NC(=N1)NS(=O)(=O)C2=CC=C(C=C2)F)C |
| InChIKey | FFRFUFIVABLWOL-UHFFFAOYSA-N |
Product Overview
N-(4,6-dimethylpyrimidin-2-yl)-4-fluorobenzenesulfonamide (CAS 312-55-0), with molecular formula C12H12FN3O2S and molecular weight 281.06 g/mol. IUPAC: N-(4,6-dimethylpyrimidin-2-yl)-4-fluorobenzenesulfonamide.
Chemical Property Profile of N-(4,6-dimethylpyrimidin-2-yl)-4-fluorobenzenesulfonamide
Property Insights of N-(4,6-dimethylpyrimidin-2-yl)-4-fluorobenzenesulfonamide
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(4,6-dimethylpyrimidin-2-yl)-4-fluorobenzenesulfonamide. The TPSA of 80.3 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(4,6-dimethylpyrimidin-2-yl)-4-fluorobenzenesulfonamide. Following Lipinski's Rule of Five, N-(4,6-dimethylpyrimidin-2-yl)-4-fluorobenzenesulfonamide has 1 hydrogen bond donor(s) and 6 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-(4,6-dimethylpyrimidin-2-yl)-4-fluorobenzenesulfonamide?
The CAS number of N-(4,6-dimethylpyrimidin-2-yl)-4-fluorobenzenesulfonamide is 312-55-0.
What is the molecular formula of N-(4,6-dimethylpyrimidin-2-yl)-4-fluorobenzenesulfonamide?
The molecular formula of N-(4,6-dimethylpyrimidin-2-yl)-4-fluorobenzenesulfonamide is C12H12FN3O2S.
What is the molecular weight of N-(4,6-dimethylpyrimidin-2-yl)-4-fluorobenzenesulfonamide?
The molecular weight of N-(4,6-dimethylpyrimidin-2-yl)-4-fluorobenzenesulfonamide is 281.06 g/mol.
Where can I buy N-(4,6-dimethylpyrimidin-2-yl)-4-fluorobenzenesulfonamide?
You can request a quote for N-(4,6-dimethylpyrimidin-2-yl)-4-fluorobenzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4,6-dimethylpyrimidin-2-yl)-4-fluorobenzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for N-(4,6-dimethylpyrimidin-2-yl)-4-fluorobenzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.