TL;DR: N-methyl-N-[(3-nitrophenyl)diazenyl]aniline (CAS 102862-66-8) is a chemical compound with molecular formula C13H12N4O2 and molecular weight 256.09604 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-methyl-N-[(3-nitrophenyl)diazenyl]aniline
Also Known As: N-methyl-N-[(3-nitrophenyl)diazenyl]aniline, N-methyl-N-(3-nitrophenyl)azoaniline, methyl-(3-nitrophenyl)azo-phenyl-amine, (1E)-3-methyl-1-(3-nitrophenyl)-3-phenyltriaz-1-ene, 1-{3-nitrophenyl}-3-methyl-3-phenyl-1-triazene
| Molecular Formula | C13H12N4O2 |
| Molecular Weight | 256.09604 g/mol |
| XLogP | 4.3 |
| Topological Polar Surface Area (TPSA) | 73.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 256.09604 Da |
| Heavy Atoms | 19 |
| Complexity | 323.0 |
| SMILES | CN(C1=CC=CC=C1)N=NC2=CC(=CC=C2)[N+](=O)[O-] |
| InChIKey | DKMHSWCFQGQCIK-UHFFFAOYSA-N |
The XLogP value of 4.3 indicates that N-methyl-N-[(3-nitrophenyl)diazenyl]aniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.8 Ų falls within the moderate polarity range, balancing permeability and solubility for N-methyl-N-[(3-nitrophenyl)diazenyl]aniline. Following Lipinski's Rule of Five, N-methyl-N-[(3-nitrophenyl)diazenyl]aniline has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of N-methyl-N-[(3-nitrophenyl)diazenyl]aniline is 102862-66-8.
The molecular formula of N-methyl-N-[(3-nitrophenyl)diazenyl]aniline is C13H12N4O2.
The molecular weight of N-methyl-N-[(3-nitrophenyl)diazenyl]aniline is 256.09604 g/mol.
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