TL;DR: 4-[(Octadecylamino)carbonyl]benzoic acid (CAS 103048-38-0) is a chemical compound with molecular formula C26H43NO3 and molecular weight 417.32428 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-(octadecylcarbamoyl)benzoic acid
Also Known As: 4-(octadecylcarbamoyl)benzoic Acid, 4-[(Octadecylamino)carbonyl]benzoic acid
Top 5 of 1 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C26H43NO3 |
| Molecular Weight | 417.32428 g/mol |
| XLogP | 8.4 |
| Topological Polar Surface Area (TPSA) | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 19 |
| Exact Mass | 417.32428 Da |
| Heavy Atoms | 30 |
| Complexity | 430.0 |
| SMILES | CCCCCCCCCCCCCCCCCCNC(=O)C1=CC=C(C=C1)C(=O)O |
| InChIKey | FKWGPLSJOABHDC-UHFFFAOYSA-N |
The XLogP value of 8.4 indicates that 4-[(Octadecylamino)carbonyl]benzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[(Octadecylamino)carbonyl]benzoic acid. Following Lipinski's Rule of Five, 4-[(Octadecylamino)carbonyl]benzoic acid has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 4-[(Octadecylamino)carbonyl]benzoic acid is 103048-38-0.
The molecular formula of 4-[(Octadecylamino)carbonyl]benzoic acid is C26H43NO3.
The molecular weight of 4-[(Octadecylamino)carbonyl]benzoic acid is 417.32428 g/mol.
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