TL;DR: US20250114359, Inhibitor 25 (CAS 122126-92-5) is a chemical compound with molecular formula C42H42N4O10S2 and molecular weight 826.23425 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-[[(Z)-[7-[(8Z)-1,6-dihydroxy-3-methyl-7-oxo-5-propan-2-yl-8-[(4-sulfamoylanilino)methylidene]naphthalen-2-yl]-3,8-dihydroxy-6-methyl-2-oxo-4-propan-2-ylnaphthalen-1-ylidene]methyl]amino]benzenesulfonamide
Also Known As: US20250114359, Inhibitor 25, 4,4'-(((1Z,1'Z)-(1,1',6,6'-tetrahydroxy-5,5'-diisopropyl-3,3'-dimethyl-7,7'-dioxo-[2,2'-binaphthalene]-8,8'(7H,7'H)-diylidene)bis(methanylylidene))bis(azanediyl))dibenzenesulfonamide, 4,4'-(((1Z,1'Z)-(1,1',6,6'-tetrahydroxy-5,5'-diisopropyl-3,3'-dimethyl-7,7'-dioxo-[2,2'-binaphthalene]-8,8'(7H,7'H)-diylidene)bis(methanylylidene))bis(azanediyl))dibenzenesulfonamide [M+H]+, 4,4'-{[1,1',6,6'-tetrahydroxy-3,3'-dimethyl-7,7'-dioxo-5,5'-di(propan-2-yl)-2,2'-binaphthalene-8,8'(7H,7'H)-diylidene]bis[(Z)methylylideneimino]}dibenzenesulfonamide, 4-({[7-(1,6-dihydroxy-3-methyl-5-(methylethyl)-7-oxo-8-{[(4-sulfamoylphenyl)am ino]methylene}(2-naphthyl))-3,8-dihydroxy-6-methyl-4-(methylethyl)-2-oxonaphth ylidene]methyl}amino)benzenesulfonamide
| Molecular Formula | C42H42N4O10S2 |
| Molecular Weight | 826.23425 g/mol |
| XLogP | 5.3 |
| Topological Polar Surface Area (TPSA) | 276.0 Ų |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 14 |
| Rotatable Bonds | 9 |
| Exact Mass | 826.23425 Da |
| Heavy Atoms | 58 |
| Complexity | 1810.0 |
| SMILES | CC1=CC2=C(C(=C1C3=C(C\4=C(C(=C(C(=O)/C4=C\NC5=CC=C(C=C5)S(=O)(=O)N)O)C(C)C)C=C3C)O)O)/C(=C/NC6=CC=C(C=C6)S(=O)(=O)N)/C(=O)C(=C2C(C)C)O |
| InChIKey | UWOSPUSBILRKLD-LZUTUTKMSA-N |
The XLogP value of 5.3 indicates that US20250114359, Inhibitor 25 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 276.0 Ų indicates high polarity, suggesting US20250114359, Inhibitor 25 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, US20250114359, Inhibitor 25 has 8 hydrogen bond donor(s) and 14 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of US20250114359, Inhibitor 25 is 122126-92-5.
The molecular formula of US20250114359, Inhibitor 25 is C42H42N4O10S2.
The molecular weight of US20250114359, Inhibitor 25 is 826.23425 g/mol.
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