TL;DR: none (CAS 154946-66-4) is a chemical compound with molecular formula C17H18ClN5O7S2 and molecular weight 503.03363 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
azane;4-chloro-5-methyl-2-[[3-methyl-5-oxo-1-(3-sulfophenyl)-4H-pyrazol-4-yl]diazenyl]benzenesulfonic acid
Also Known As: none, Benzenesulfonic acid, 4-chloro-2-[2-[4,5-dihydro-3-methyl-5-oxo-1-(3-sulfophenyl)-1H-pyrazol-4-yl]diazenyl]-5-methyl-, ammonium salt (1:2), 4-chloro-2-[[(4,5-dihydro-3-methyl-5-oxo-1-(3-sulfophenyl)-1H-pyrazol-4-yl)azo]-5-methylbenzenesulfonic acid, diammonium salt (Keto form), azane; 4-chloro-5-methyl-2-[[3-methyl-5-oxo-1-(3-sulfophenyl)-4H-pyrazol-4-yl]diazenyl]benzenesulfonic acid
| Molecular Formula | C17H18ClN5O7S2 |
| Molecular Weight | 503.03363 g/mol |
| XLogP | 3.17882 |
| Topological Polar Surface Area (TPSA) | 184.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 5 |
| Exact Mass | 503.03363 Da |
| Heavy Atoms | 32 |
| Complexity | 973.0 |
| SMILES | CC1=CC(=C(C=C1Cl)N=NC2C(=NN(C2=O)C3=CC(=CC=C3)S(=O)(=O)O)C)S(=O)(=O)O.N |
| InChIKey | ZFNSNBVGUIVMOY-UHFFFAOYSA-N |
The XLogP value of 3.17882 indicates that none is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 184.0 Ų indicates high polarity, suggesting none may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, none has 3 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of none is 154946-66-4.
The molecular formula of none is C17H18ClN5O7S2.
The molecular weight of none is 503.03363 g/mol.
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