TL;DR: N-(3-chloro-4-hydroxy-5-tosylphenyl)-4-methyl-N-tosylbenzenesulfonamide (CAS 100073-61-8) is a chemical compound with molecular formula C27H24ClNO7S3 and molecular weight 605.04034 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[3-chloro-4-hydroxy-5-(4-methylphenyl)sulfonylphenyl]-4-methyl-N-(4-methylphenyl)sulfonylbenzenesulfonamide
Also Known As: N-(3-chloro-4-hydroxy-5-tosylphenyl)-4-methyl-N-tosylbenzenesulfonamide, N-(2,4-Dinitro-phenyl)-N'-[1-[4-(4-ethoxy-phenyl)-cyclohexyl]-eth-(Z)-ylidene]-hydrazine, N-[3-chloro-4-hydroxy-5-(4-methylphenyl)sulfonylphenyl]-4-methyl-N-(4-methylphenyl)sulfonylbenzenesulfonamide
| Molecular Formula | C27H24ClNO7S3 |
| Molecular Weight | 605.04034 g/mol |
| XLogP | 6.5 |
| Topological Polar Surface Area (TPSA) | 151.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 605.04034 Da |
| Heavy Atoms | 39 |
| Complexity | 1080.0 |
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)C2=C(C(=CC(=C2)N(S(=O)(=O)C3=CC=C(C=C3)C)S(=O)(=O)C4=CC=C(C=C4)C)Cl)O |
| InChIKey | AVLVZXRJAPWRNR-UHFFFAOYSA-N |
The XLogP value of 6.5 indicates that N-(3-chloro-4-hydroxy-5-tosylphenyl)-4-methyl-N-tosylbenzenesulfonamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 151.0 Ų indicates high polarity, suggesting N-(3-chloro-4-hydroxy-5-tosylphenyl)-4-methyl-N-tosylbenzenesulfonamide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, N-(3-chloro-4-hydroxy-5-tosylphenyl)-4-methyl-N-tosylbenzenesulfonamide has 1 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of N-(3-chloro-4-hydroxy-5-tosylphenyl)-4-methyl-N-tosylbenzenesulfonamide is 100073-61-8.
The molecular formula of N-(3-chloro-4-hydroxy-5-tosylphenyl)-4-methyl-N-tosylbenzenesulfonamide is C27H24ClNO7S3.
The molecular weight of N-(3-chloro-4-hydroxy-5-tosylphenyl)-4-methyl-N-tosylbenzenesulfonamide is 605.04034 g/mol.
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