TL;DR: N-[1-(1H-benzimidazol-2-yl)butyl]-3-bromobenzamide (CAS 497940-61-1) is a chemical compound with molecular formula C18H18BrN3O and molecular weight 371.06332 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[1-(1H-benzimidazol-2-yl)butyl]-3-bromobenzamide
Also Known As: N-[1-(1H-benzimidazol-2-yl)butyl]-3-bromobenzamide, N-(1-(1H-benzo[d]imidazol-2-yl)butyl)-3-bromobenzamide
| Molecular Formula | C18H18BrN3O |
| Molecular Weight | 371.06332 g/mol |
| XLogP | 4.3 |
| Topological Polar Surface Area (TPSA) | 57.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 371.06332 Da |
| Heavy Atoms | 23 |
| Complexity | 406.0 |
| SMILES | CCCC(C1=NC2=CC=CC=C2N1)NC(=O)C3=CC(=CC=C3)Br |
| InChIKey | TYBJYLIJUQBXHX-UHFFFAOYSA-N |
The XLogP value of 4.3 indicates that N-[1-(1H-benzimidazol-2-yl)butyl]-3-bromobenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.8 Ų, N-[1-(1H-benzimidazol-2-yl)butyl]-3-bromobenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[1-(1H-benzimidazol-2-yl)butyl]-3-bromobenzamide has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of N-[1-(1H-benzimidazol-2-yl)butyl]-3-bromobenzamide is 497940-61-1.
The molecular formula of N-[1-(1H-benzimidazol-2-yl)butyl]-3-bromobenzamide is C18H18BrN3O.
The molecular weight of N-[1-(1H-benzimidazol-2-yl)butyl]-3-bromobenzamide is 371.06332 g/mol.
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