![N-(2,6-dimethoxy-4-pyrimidinyl)-4-({[(4-fluorophenyl)amino]carbonothioyl}amino)benzenesulfonamide structure](/static/products/314/314765-89-4.png)
N-(2,6-dimethoxy-4-pyrimidinyl)-4-({[(4-fluorophenyl)amino]carbonothioyl}amino)benzenesulfonamide
TL;DR: N-(2,6-dimethoxy-4-pyrimidinyl)-4-({[(4-fluorophenyl)amino]carbonothioyl}amino)benzenesulfonamide (CAS 314765-89-4) is a chemical compound with molecular formula C19H18FN5O4S2 and molecular weight 463.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[4-[(2,6-dimethoxypyrimidin-4-yl)sulfamoyl]phenyl]-3-(4-fluorophenyl)thiourea
Also Known As: N-(2,6-dimethoxy-4-pyrimidinyl)-4-({[(4-fluorophenyl)amino]carbonothioyl}amino)benzenesulfonamide, 1-[4-[(2,6-dimethoxypyrimidin-4-yl)sulfamoyl]phenyl]-3-(4-fluorophenyl)thiourea, N-(2,6-dimethoxypyrimidin-4-yl)-4-{[(4-fluorophenyl)carbamothioyl]amino}benzenesulfonamide
| Molecular Formula | C19H18FN5O4S2 |
|---|---|
| Molecular Weight | 463.08 g/mol |
| LogP | 3.2426 |
| Topological Polar Surface Area | 114.47 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 463.07843 |
| Heavy Atoms | 31 |
| Complexity | 1150.6575 |
Chemical Identifiers
| CAS Number | 314765-89-4 |
|---|---|
| SMILES | COC1=NC(=NC(=C1)NS(=O)(=O)C2=CC=C(C=C2)NC(=S)NC3=CC=C(C=C3)F)OC |
Product Overview
N-(2,6-dimethoxy-4-pyrimidinyl)-4-({[(4-fluorophenyl)amino]carbonothioyl}amino)benzenesulfonamide (CAS 314765-89-4), with molecular formula C19H18FN5O4S2 and molecular weight 463.08 g/mol. IUPAC: 1-[4-[(2,6-dimethoxypyrimidin-4-yl)sulfamoyl]phenyl]-3-(4-fluorophenyl)thiourea.
Chemical Property Profile of N-(2,6-dimethoxy-4-pyrimidinyl)-4-({[(4-fluorophenyl)amino]carbonothioyl}amino)benzenesulfonamide
Property Insights of N-(2,6-dimethoxy-4-pyrimidinyl)-4-({[(4-fluorophenyl)amino]carbonothioyl}amino)benzenesulfonamide
The XLogP value of 3.2426 indicates that N-(2,6-dimethoxy-4-pyrimidinyl)-4-({[(4-fluorophenyl)amino]carbonothioyl}amino)benzenesulfonamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 114.47 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(2,6-dimethoxy-4-pyrimidinyl)-4-({[(4-fluorophenyl)amino]carbonothioyl}amino)benzenesulfonamide. Following Lipinski's Rule of Five, N-(2,6-dimethoxy-4-pyrimidinyl)-4-({[(4-fluorophenyl)amino]carbonothioyl}amino)benzenesulfonamide has 3 hydrogen bond donor(s) and 7 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-(2,6-dimethoxy-4-pyrimidinyl)-4-({[(4-fluorophenyl)amino]carbonothioyl}amino)benzenesulfonamide?
The CAS number of N-(2,6-dimethoxy-4-pyrimidinyl)-4-({[(4-fluorophenyl)amino]carbonothioyl}amino)benzenesulfonamide is 314765-89-4.
What is the molecular formula of N-(2,6-dimethoxy-4-pyrimidinyl)-4-({[(4-fluorophenyl)amino]carbonothioyl}amino)benzenesulfonamide?
The molecular formula of N-(2,6-dimethoxy-4-pyrimidinyl)-4-({[(4-fluorophenyl)amino]carbonothioyl}amino)benzenesulfonamide is C19H18FN5O4S2.
What is the molecular weight of N-(2,6-dimethoxy-4-pyrimidinyl)-4-({[(4-fluorophenyl)amino]carbonothioyl}amino)benzenesulfonamide?
The molecular weight of N-(2,6-dimethoxy-4-pyrimidinyl)-4-({[(4-fluorophenyl)amino]carbonothioyl}amino)benzenesulfonamide is 463.08 g/mol.
Where can I buy N-(2,6-dimethoxy-4-pyrimidinyl)-4-({[(4-fluorophenyl)amino]carbonothioyl}amino)benzenesulfonamide?
You can request a quote for N-(2,6-dimethoxy-4-pyrimidinyl)-4-({[(4-fluorophenyl)amino]carbonothioyl}amino)benzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2,6-dimethoxy-4-pyrimidinyl)-4-({[(4-fluorophenyl)amino]carbonothioyl}amino)benzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for N-(2,6-dimethoxy-4-pyrimidinyl)-4-({[(4-fluorophenyl)amino]carbonothioyl}amino)benzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.