TL;DR: 4-Butylbenzamide (CAS 107377-07-1) is a chemical compound with molecular formula C11H15NO and molecular weight 177.11537 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-butylbenzamide
Also Known As: 4-butylbenzamide, 4-n-butylbenzamide, p-Butylbenzamid, Benzamide, 4-butyl-, 4-butyl-benzoic acid amide
| Molecular Formula | C11H15NO |
| Molecular Weight | 177.11537 g/mol |
| XLogP | 3.3 |
| Topological Polar Surface Area (TPSA) | 43.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 177.11537 Da |
| Heavy Atoms | 13 |
| Complexity | 159.0 |
| SMILES | CCCCC1=CC=C(C=C1)C(=O)N |
| InChIKey | KFINRIKJBULSTD-UHFFFAOYSA-N |
The XLogP value of 3.3 indicates that 4-Butylbenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.1 Ų, 4-Butylbenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Butylbenzamide has 1 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-Butylbenzamide is 107377-07-1.
The molecular formula of 4-Butylbenzamide is C11H15NO.
The molecular weight of 4-Butylbenzamide is 177.11537 g/mol.
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