TL;DR: Hexanoic acid, 6-((2-((4-ethoxybenzoyl)amino)-1-oxo-3-phenyl-2-propenyl)amino)- (CAS 172798-56-0) is a chemical compound with molecular formula C24H28N2O5 and molecular weight 424.19983 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6-[[(Z)-2-[(4-ethoxybenzoyl)amino]-3-phenylprop-2-enoyl]amino]hexanoic acid
Also Known As: 6-((2-((4-Ethoxybenzoyl)amino)-1-oxo-3-phenyl-2-propenyl)amino)hexanoic acid, Hexanoic acid, 6-((2-((4-ethoxybenzoyl)amino)-1-oxo-3-phenyl-2-propenyl)amino)-, 6-[[(Z)-2-[(4-ethoxybenzoyl)amino]-3-phenylprop-2-enoyl]amino]hexanoic acid
| Molecular Formula | C24H28N2O5 |
| Molecular Weight | 424.19983 g/mol |
| XLogP | 3.6 |
| Topological Polar Surface Area (TPSA) | 105.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 12 |
| Exact Mass | 424.19983 Da |
| Heavy Atoms | 31 |
| Complexity | 605.0 |
| SMILES | CCOC1=CC=C(C=C1)C(=O)N/C(=C\C2=CC=CC=C2)/C(=O)NCCCCCC(=O)O |
| InChIKey | IZXAGYRAJDEHOO-FXBPSFAMSA-N |
The XLogP value of 3.6 indicates that Hexanoic acid, 6-((2-((4-ethoxybenzoyl)amino)-1-oxo-3-phenyl-2-propenyl)amino)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 105.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Hexanoic acid, 6-((2-((4-ethoxybenzoyl)amino)-1-oxo-3-phenyl-2-propenyl)amino)-. Following Lipinski's Rule of Five, Hexanoic acid, 6-((2-((4-ethoxybenzoyl)amino)-1-oxo-3-phenyl-2-propenyl)amino)- has 3 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Hexanoic acid, 6-((2-((4-ethoxybenzoyl)amino)-1-oxo-3-phenyl-2-propenyl)amino)- is 172798-56-0.
The molecular formula of Hexanoic acid, 6-((2-((4-ethoxybenzoyl)amino)-1-oxo-3-phenyl-2-propenyl)amino)- is C24H28N2O5.
The molecular weight of Hexanoic acid, 6-((2-((4-ethoxybenzoyl)amino)-1-oxo-3-phenyl-2-propenyl)amino)- is 424.19983 g/mol.
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