TL;DR: 4-(bromomethyl)-N-[2-(1H-indol-3-yl)ethyl]benzamide (CAS 118507-22-5) is a chemical compound with molecular formula C18H17BrN2O and molecular weight 356.05243 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-(bromomethyl)-N-[2-(1H-indol-3-yl)ethyl]benzamide
Also Known As: 4-(bromomethyl)-N-[2-(1H-indol-3-yl)ethyl]benzamide, (4-(BROMOMETHYL)PHENYL)-N-(2-INDOL-3-YLETHYL)FORMAMIDE, [4-(bromomethyl)phenyl]-N-(2-indol-3-ylethyl)carboxamide, C18H17BrN2O
| Molecular Formula | C18H17BrN2O |
| Molecular Weight | 356.05243 g/mol |
| XLogP | 4.0 |
| Topological Polar Surface Area (TPSA) | 44.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 356.05243 Da |
| Heavy Atoms | 22 |
| Complexity | 368.0 |
| SMILES | C1=CC=C2C(=C1)C(=CN2)CCNC(=O)C3=CC=C(C=C3)CBr |
| InChIKey | TUFNAPRFCYAXFS-UHFFFAOYSA-N |
The XLogP value of 4.0 indicates that 4-(bromomethyl)-N-[2-(1H-indol-3-yl)ethyl]benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.9 Ų, 4-(bromomethyl)-N-[2-(1H-indol-3-yl)ethyl]benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(bromomethyl)-N-[2-(1H-indol-3-yl)ethyl]benzamide has 2 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 4-(bromomethyl)-N-[2-(1H-indol-3-yl)ethyl]benzamide is 118507-22-5.
The molecular formula of 4-(bromomethyl)-N-[2-(1H-indol-3-yl)ethyl]benzamide is C18H17BrN2O.
The molecular weight of 4-(bromomethyl)-N-[2-(1H-indol-3-yl)ethyl]benzamide is 356.05243 g/mol.
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