TL;DR: 4-Amino-3-methoxy-4'-nitroazobenzene (CAS 101-52-0) is a chemical compound with molecular formula C13H12N4O3 and molecular weight 272.09094 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-methoxy-4-[(4-nitrophenyl)diazenyl]aniline
Also Known As: 4-((4-Nitrophenyl)azo)-o-anisidine, 2-Methoxy-4-[(4-nitrophenyl)azo]aniline, 2-methoxy-4-[(4-nitrophenyl)diazenyl]aniline, 4-Amino-3-methoxy-4'-nitroazobenzene, 2-Methoxy-4-((4-nitrophenyl)azo)aniline
Top 5 of 1 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C13H12N4O3 |
| Molecular Weight | 272.09094 g/mol |
| XLogP | 3.2 |
| Topological Polar Surface Area (TPSA) | 106.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 272.09094 Da |
| Heavy Atoms | 20 |
| Complexity | 350.0 |
| SMILES | COC1=C(C=CC(=C1)N=NC2=CC=C(C=C2)[N+](=O)[O-])N |
| InChIKey | UXLCBMUEIPAQSZ-UHFFFAOYSA-N |
The XLogP value of 3.2 indicates that 4-Amino-3-methoxy-4'-nitroazobenzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 106.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Amino-3-methoxy-4'-nitroazobenzene. Following Lipinski's Rule of Five, 4-Amino-3-methoxy-4'-nitroazobenzene has 1 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-Amino-3-methoxy-4'-nitroazobenzene is 101-52-0.
The molecular formula of 4-Amino-3-methoxy-4'-nitroazobenzene is C13H12N4O3.
The molecular weight of 4-Amino-3-methoxy-4'-nitroazobenzene is 272.09094 g/mol.
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