TL;DR: 4-[(2-Nitrophenyl)diazenyl]benzene-1,3-diol (CAS 142785-20-4) is a chemical compound with molecular formula C12H9N3O4 and molecular weight 259.0593 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-[(2-nitrophenyl)diazenyl]benzene-1,3-diol
Also Known As: 4-(2-Nitrophenylazo)resorcinol, 1,3-Benzenediol, 4-[(nitrophenyl)azo]-, 4-[(2-Nitrophenyl)azo]-1,3-benzenediol, 4-((2-nitrophenyl)diazenyl)benzene-1,3-diol, 4-[2-(2-nitrophenyl)diazen-1-yl]benzene-1,3-diol
Top 5 of 4 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C12H9N3O4 |
| Molecular Weight | 259.0593 g/mol |
| XLogP | 2.8 |
| Topological Polar Surface Area (TPSA) | 111.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 259.0593 Da |
| Heavy Atoms | 19 |
| Complexity | 344.0 |
| SMILES | C1=CC=C(C(=C1)N=NC2=C(C=C(C=C2)O)O)[N+](=O)[O-] |
| InChIKey | FIIZIGIBHJBQIJ-UHFFFAOYSA-N |
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[(2-Nitrophenyl)diazenyl]benzene-1,3-diol. The TPSA of 111.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[(2-Nitrophenyl)diazenyl]benzene-1,3-diol. Following Lipinski's Rule of Five, 4-[(2-Nitrophenyl)diazenyl]benzene-1,3-diol has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 4-[(2-Nitrophenyl)diazenyl]benzene-1,3-diol is 142785-20-4.
The molecular formula of 4-[(2-Nitrophenyl)diazenyl]benzene-1,3-diol is C12H9N3O4.
The molecular weight of 4-[(2-Nitrophenyl)diazenyl]benzene-1,3-diol is 259.0593 g/mol.
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