4-(benzylsulfonylamino)-N-(4-methylpyrimidin-2-yl)benzenesulfonamide
TL;DR: 4-(benzylsulfonylamino)-N-(4-methylpyrimidin-2-yl)benzenesulfonamide (CAS 333443-03-1) is a chemical compound with molecular formula C18H18N4O4S2 and molecular weight 418.07693 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-(benzylsulfonylamino)-N-(4-methylpyrimidin-2-yl)benzenesulfonamide
Also Known As: 4-(benzylsulfonylamino)-N-(4-methylpyrimidin-2-yl)benzenesulfonamide, (4-{[(4-methylpyrimidin-2-yl)amino]sulfonyl}phenyl)[benzylsulfonyl]amine, 4-[(benzylsulfonyl)amino]-N-(4-methylpyrimidin-2-yl)benzenesulfonamide
Technical Specifications
| Molecular Formula | C18H18N4O4S2 |
| Molecular Weight | 418.07693 g/mol |
| XLogP | 1.3 |
| Topological Polar Surface Area (TPSA) | 135.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 418.07693 Da |
| Heavy Atoms | 28 |
| Complexity | 688.0 |
| SMILES | CC1=NC(=NC=C1)NS(=O)(=O)C2=CC=C(C=C2)NS(=O)(=O)CC3=CC=CC=C3 |
| InChIKey | BLWAXBDBQWGJKK-UHFFFAOYSA-N |
Chemical Property Profile of 4-(benzylsulfonylamino)-N-(4-methylpyrimidin-2-yl)benzenesulfonamide
Property Insights of 4-(benzylsulfonylamino)-N-(4-methylpyrimidin-2-yl)benzenesulfonamide
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(benzylsulfonylamino)-N-(4-methylpyrimidin-2-yl)benzenesulfonamide. The TPSA of 135.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(benzylsulfonylamino)-N-(4-methylpyrimidin-2-yl)benzenesulfonamide. Following Lipinski's Rule of Five, 4-(benzylsulfonylamino)-N-(4-methylpyrimidin-2-yl)benzenesulfonamide has 2 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 4-(benzylsulfonylamino)-N-(4-methylpyrimidin-2-yl)benzenesulfonamide?
The CAS number of 4-(benzylsulfonylamino)-N-(4-methylpyrimidin-2-yl)benzenesulfonamide is 333443-03-1.
What is the molecular formula of 4-(benzylsulfonylamino)-N-(4-methylpyrimidin-2-yl)benzenesulfonamide?
The molecular formula of 4-(benzylsulfonylamino)-N-(4-methylpyrimidin-2-yl)benzenesulfonamide is C18H18N4O4S2.
What is the molecular weight of 4-(benzylsulfonylamino)-N-(4-methylpyrimidin-2-yl)benzenesulfonamide?
The molecular weight of 4-(benzylsulfonylamino)-N-(4-methylpyrimidin-2-yl)benzenesulfonamide is 418.07693 g/mol.
Where can I buy 4-(benzylsulfonylamino)-N-(4-methylpyrimidin-2-yl)benzenesulfonamide?
You can request a quote for 4-(benzylsulfonylamino)-N-(4-methylpyrimidin-2-yl)benzenesulfonamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-(benzylsulfonylamino)-N-(4-methylpyrimidin-2-yl)benzenesulfonamide?
Yes, CoreyChem provides custom synthesis services for 4-(benzylsulfonylamino)-N-(4-methylpyrimidin-2-yl)benzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.