TL;DR: Acetamide, 2-chloro-N-((6-nitro-1H-benzimidazol-1-yl)methyl)- (CAS 103706-78-1) is a chemical compound with molecular formula C10H9ClN4O3 and molecular weight 268.03632 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-chloro-N-[(6-nitrobenzimidazol-1-yl)methyl]acetamide
Also Known As: Acetamide, 2-chloro-N-((6-nitro-1H-benzimidazol-1-yl)methyl)-, 2-Chloro-N-((6-nitro-1H-benzimidazol-1-yl)methyl)acetamide, 2-chloro-N-[(6-nitrobenzimidazol-1-yl)methyl]acetamide, 2-Chloro-N-[(6-nitro-1H-1,3-benzimidazol-1-yl)methyl]acetamide
| Molecular Formula | C10H9ClN4O3 |
| Molecular Weight | 268.03632 g/mol |
| XLogP | 1.2 |
| Topological Polar Surface Area (TPSA) | 92.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 268.03632 Da |
| Heavy Atoms | 18 |
| Complexity | 336.0 |
| SMILES | C1=CC2=C(C=C1[N+](=O)[O-])N(C=N2)CNC(=O)CCl |
| InChIKey | NKILYJJPIKQDBL-UHFFFAOYSA-N |
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Acetamide, 2-chloro-N-((6-nitro-1H-benzimidazol-1-yl)methyl)-. The TPSA of 92.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Acetamide, 2-chloro-N-((6-nitro-1H-benzimidazol-1-yl)methyl)-. Following Lipinski's Rule of Five, Acetamide, 2-chloro-N-((6-nitro-1H-benzimidazol-1-yl)methyl)- has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Acetamide, 2-chloro-N-((6-nitro-1H-benzimidazol-1-yl)methyl)- is 103706-78-1.
The molecular formula of Acetamide, 2-chloro-N-((6-nitro-1H-benzimidazol-1-yl)methyl)- is C10H9ClN4O3.
The molecular weight of Acetamide, 2-chloro-N-((6-nitro-1H-benzimidazol-1-yl)methyl)- is 268.03632 g/mol.
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