TL;DR: 4-Aminoazobenzene-3,4'-disulfonic acid (CAS 101-50-8) is a chemical compound with molecular formula C12H11N3O6S2 and molecular weight 357.00894 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-amino-5-[(4-sulfophenyl)diazenyl]benzenesulfonic acid
Also Known As: 4-Aminoazobenzene-3,4'-disulfonic acid, 4-Amino-3,4'-disulfoazobenzene, 4-Aminoazobenzene-3,4'-disulphonic acid, Azobenzene-3, 4-amino-, NCIOpen2_007520
Top 5 of 11 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C12H11N3O6S2 |
| Molecular Weight | 357.00894 g/mol |
| XLogP | 0.2 |
| Topological Polar Surface Area (TPSA) | 176.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 4 |
| Exact Mass | 357.00894 Da |
| Heavy Atoms | 23 |
| Complexity | 629.0 |
| SMILES | C1=CC(=CC=C1N=NC2=CC(=C(C=C2)N)S(=O)(=O)O)S(=O)(=O)O |
| InChIKey | DCYBHNIOTZBCFS-UHFFFAOYSA-N |
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Aminoazobenzene-3,4'-disulfonic acid. The TPSA of 176.0 Ų indicates high polarity, suggesting 4-Aminoazobenzene-3,4'-disulfonic acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 4-Aminoazobenzene-3,4'-disulfonic acid has 3 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 4-Aminoazobenzene-3,4'-disulfonic acid is 101-50-8.
The molecular formula of 4-Aminoazobenzene-3,4'-disulfonic acid is C12H11N3O6S2.
The molecular weight of 4-Aminoazobenzene-3,4'-disulfonic acid is 357.00894 g/mol.
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