TL;DR: CTK2F4188 (CAS 62106-21-2) is a chemical compound with molecular formula C22H28Cl2N6O6S and molecular weight 574.1168 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-[(5-amino-3-methyl-1-phenylpyrazol-4-yl)diazenyl]-2,5-dichlorobenzenesulfonic acid;2-[bis(2-hydroxyethyl)amino]ethanol
Also Known As: Benzenesulfonic acid, 4-[(5-amino-3-methyl-1-phenyl-1H-pyrazol-4-yl)azo]-2,5-dichloro-, compd. with 2,2',2''-nitrilotris[ethanol] (1:1), 2-(bis(2-hydroxyethyl)amino)ethanol; 2,5-dichloro-4-[(2E)-2-(5-imino-3-methyl-1-phenyl-pyrazol-4-ylidene)hydrazinyl]benzenesulfonic acid, 4-((5-Amino-3-methyl-1-phenyl-1H-pyrazol-4-yl)azo)-2,5-dichlorobenzenesulfonic acid, compd. with 2,2',2''-nitrilotris(ethanol) (1:1), Benzenesulfonic acid, 4-((5-amino-3-methyl-1-phenyl-1H-pyrazol-4-yl)azo)-2,5-dichloro-, compd. with 2,2',2''-nitrilotris(ethanol) (1:1), Benzenesulfonic acid, 4-(2-(5-amino-3-methyl-1-phenyl-1H-pyrazol-4-yl)diazenyl)-2,5-dichloro-, compd. with 2,2',2''-nitrilotris(ethanol) (1:1)
| Molecular Formula | C22H28Cl2N6O6S |
| Molecular Weight | 574.1168 g/mol |
| XLogP | 3.0 |
| Topological Polar Surface Area (TPSA) | 195.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 10 |
| Exact Mass | 574.1168 Da |
| Heavy Atoms | 37 |
| Complexity | 696.0 |
| SMILES | CC1=NN(C(=C1N=NC2=CC(=C(C=C2Cl)S(=O)(=O)O)Cl)N)C3=CC=CC=C3.C(CO)N(CCO)CCO |
| InChIKey | JXWGOVHOROKRSH-UHFFFAOYSA-N |
The XLogP value of 3.0 indicates that CTK2F4188 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 195.0 Ų indicates high polarity, suggesting CTK2F4188 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, CTK2F4188 has 5 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of CTK2F4188 is 62106-21-2.
The molecular formula of CTK2F4188 is C22H28Cl2N6O6S.
The molecular weight of CTK2F4188 is 574.1168 g/mol.
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