TL;DR: CID 6328425 (CAS 112027-18-6) is a chemical compound with molecular formula C28H24ClN7O10S3 and molecular weight 749.0435 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-[[4-chloro-6-(N-ethylanilino)-1,3,5-triazin-2-yl]amino]-4-hydroxy-3-[(4-methyl-2-sulfophenyl)diazenyl]naphthalene-2,7-disulfonic acid
Also Known As: 5-((4-Chloro-6-(ethyl(phenyl)amino)-1,3,5-triazin-2-yl)amino)-4-hydroxy-3-((4-methyl-2-sulfophenyl)diazenyl)-2,7-naphthalenedisulfonic acid, (3Z)-5-[[4-chloro-6-(N-ethylanilino)-1,3,5-triazin-2-yl]amino]-3-[(4-methyl-2-sulfophenyl)hydrazinylidene]-4-oxonaphthalene-2,7-disulfonic acid
| Molecular Formula | C28H24ClN7O10S3 |
| Molecular Weight | 749.0435 g/mol |
| XLogP | 5.0 |
| Topological Polar Surface Area (TPSA) | 287.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 17 |
| Rotatable Bonds | 10 |
| Exact Mass | 749.0435 Da |
| Heavy Atoms | 49 |
| Complexity | 1490.0 |
| SMILES | CCN(C1=CC=CC=C1)C2=NC(=NC(=N2)NC3=C4C(=CC(=C3)S(=O)(=O)O)C=C(C(=C4O)N=NC5=C(C=C(C=C5)C)S(=O)(=O)O)S(=O)(=O)O)Cl |
| InChIKey | JZDBXCVOHRQNDX-UHFFFAOYSA-N |
The XLogP value of 5.0 indicates that CID 6328425 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 287.0 Ų indicates high polarity, suggesting CID 6328425 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, CID 6328425 has 5 hydrogen bond donor(s) and 17 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of CID 6328425 is 112027-18-6.
The molecular formula of CID 6328425 is C28H24ClN7O10S3.
The molecular weight of CID 6328425 is 749.0435 g/mol.
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