TL;DR: N-[(4-nitrophenyl)methylideneamino]-1H-benzimidazol-2-amine (CAS 113423-98-6) is a chemical compound with molecular formula C14H11N5O2 and molecular weight 281.09128 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[(4-nitrophenyl)methylideneamino]-1H-benzimidazol-2-amine
Also Known As: n-(1h-benzoimidazol-2-yl)-n'-(4-nitro-benzylidene)-hydrazine, N-[(4-nitrophenyl)methylideneamino]-1H-benzimidazol-2-amine, GNF-Pf-4119
| Molecular Formula | C14H11N5O2 |
| Molecular Weight | 281.09128 g/mol |
| XLogP | 3.3 |
| Topological Polar Surface Area (TPSA) | 98.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 281.09128 Da |
| Heavy Atoms | 21 |
| Complexity | 389.0 |
| SMILES | C1=CC=C2C(=C1)NC(=N2)NN=CC3=CC=C(C=C3)[N+](=O)[O-] |
| InChIKey | OWDSNDZARSGGNT-UHFFFAOYSA-N |
The XLogP value of 3.3 indicates that N-[(4-nitrophenyl)methylideneamino]-1H-benzimidazol-2-amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 98.9 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[(4-nitrophenyl)methylideneamino]-1H-benzimidazol-2-amine. Following Lipinski's Rule of Five, N-[(4-nitrophenyl)methylideneamino]-1H-benzimidazol-2-amine has 2 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-[(4-nitrophenyl)methylideneamino]-1H-benzimidazol-2-amine is 113423-98-6.
The molecular formula of N-[(4-nitrophenyl)methylideneamino]-1H-benzimidazol-2-amine is C14H11N5O2.
The molecular weight of N-[(4-nitrophenyl)methylideneamino]-1H-benzimidazol-2-amine is 281.09128 g/mol.
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