![N-[[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]carbamothioyl]-3-iodo-4-methoxybenzamide structure](/static/products/6429/642961-84-0.webp)
N-[[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]carbamothioyl]-3-iodo-4-methoxybenzamide
TL;DR: N-[[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]carbamothioyl]-3-iodo-4-methoxybenzamide (CAS 642961-84-0) is a chemical compound with molecular formula C21H20IN5O4S2 and molecular weight 597.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]carbamothioyl]-3-iodo-4-methoxybenzamide
Also Known As: N-[[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]carbamothioyl]-3-iodo-4-methoxybenzamide, N-{[(4-{[(4,6-dimethyl-2-pyrimidinyl)amino]sulfonyl}phenyl)amino]carbonothioyl}-3-iodo-4-methoxybenzamide, N-({4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl}carbamothioyl)-3-iodo-4-methoxybenzamide
| Molecular Formula | C21H20IN5O4S2 |
|---|---|
| Molecular Weight | 597.00 g/mol |
| LogP | 3.63424 |
| Topological Polar Surface Area | 122.31 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 597.0001 |
| Heavy Atoms | 33 |
| Complexity | 1294.4803 |
Chemical Identifiers
| CAS Number | 642961-84-0 |
|---|---|
| SMILES | CC1=CC(=NC(=N1)NS(=O)(=O)C2=CC=C(C=C2)NC(=S)NC(=O)C3=CC(=C(C=C3)OC)I)C |
Product Overview
N-[[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]carbamothioyl]-3-iodo-4-methoxybenzamide (CAS 642961-84-0), with molecular formula C21H20IN5O4S2 and molecular weight 597.00 g/mol. IUPAC: N-[[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]carbamothioyl]-3-iodo-4-methoxybenzamide.
Chemical Property Profile of N-[[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]carbamothioyl]-3-iodo-4-methoxybenzamide
Property Insights of N-[[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]carbamothioyl]-3-iodo-4-methoxybenzamide
The XLogP value of 3.63424 indicates that N-[[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]carbamothioyl]-3-iodo-4-methoxybenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 122.31 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]carbamothioyl]-3-iodo-4-methoxybenzamide. Following Lipinski's Rule of Five, N-[[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]carbamothioyl]-3-iodo-4-methoxybenzamide has 3 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-[[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]carbamothioyl]-3-iodo-4-methoxybenzamide?
The CAS number of N-[[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]carbamothioyl]-3-iodo-4-methoxybenzamide is 642961-84-0.
What is the molecular formula of N-[[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]carbamothioyl]-3-iodo-4-methoxybenzamide?
The molecular formula of N-[[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]carbamothioyl]-3-iodo-4-methoxybenzamide is C21H20IN5O4S2.
What is the molecular weight of N-[[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]carbamothioyl]-3-iodo-4-methoxybenzamide?
The molecular weight of N-[[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]carbamothioyl]-3-iodo-4-methoxybenzamide is 597.00 g/mol.
Where can I buy N-[[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]carbamothioyl]-3-iodo-4-methoxybenzamide?
You can request a quote for N-[[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]carbamothioyl]-3-iodo-4-methoxybenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]carbamothioyl]-3-iodo-4-methoxybenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-[[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]carbamothioyl]-3-iodo-4-methoxybenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.