TL;DR: 2-[2-Hydroxyethyl-[(4-nitrophenyl)diazenyl]amino]ethanol (CAS 1164504-31-7) is a chemical compound with molecular formula C10H14N4O4 and molecular weight 254.1015 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[2-hydroxyethyl-[(4-nitrophenyl)diazenyl]amino]ethanol
Also Known As: 2-(1-(2-hydroxyethyl)-3-{4-nitrophenyl}-2-triazenyl)ethanol, J1.885.868A, AH-034/11365346, 1-(4-Nitrophenyl)-3,3-bis(2-hydroxyethyl)triazene, 2-[2-hydroxyethyl-[(4-nitrophenyl)diazenyl]amino]ethanol
| Molecular Formula | C10H14N4O4 |
| Molecular Weight | 254.1015 g/mol |
| XLogP | 2.1 |
| Topological Polar Surface Area (TPSA) | 114.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 254.1015 Da |
| Heavy Atoms | 18 |
| Complexity | 268.0 |
| SMILES | C1=CC(=CC=C1N=NN(CCO)CCO)[N+](=O)[O-] |
| InChIKey | PDDDTXPMDLWDDP-UHFFFAOYSA-N |
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[2-Hydroxyethyl-[(4-nitrophenyl)diazenyl]amino]ethanol. The TPSA of 114.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[2-Hydroxyethyl-[(4-nitrophenyl)diazenyl]amino]ethanol. Following Lipinski's Rule of Five, 2-[2-Hydroxyethyl-[(4-nitrophenyl)diazenyl]amino]ethanol has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2-[2-Hydroxyethyl-[(4-nitrophenyl)diazenyl]amino]ethanol is 1164504-31-7.
The molecular formula of 2-[2-Hydroxyethyl-[(4-nitrophenyl)diazenyl]amino]ethanol is C10H14N4O4.
The molecular weight of 2-[2-Hydroxyethyl-[(4-nitrophenyl)diazenyl]amino]ethanol is 254.1015 g/mol.
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