TL;DR: Exp 6155 (CAS 121280-51-1) is a chemical compound with molecular formula C17H17ClN2Na2O4 and molecular weight 394.06723 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
disodium;4-[[2-butyl-5-(carboxylatomethyl)-4-chloroimidazol-1-yl]methyl]benzoate
Also Known As: Exp 6155, 2-n-Butyl-1-(4-carboxybenzyl)-4-chloroimidazole-5-acetic acid, 1H-Imidazole-5-acetic acid, 2-butyl-1-((4-carboxyphenyl)methyl)-4-chloro-, disodium salt, disodium;4-[[2-butyl-5-(carboxylatomethyl)-4-chloroimidazol-1-yl]methyl]benzoate, disodium 4-[[2-butyl-4-chloro-5-(2-oxido-2-oxoethyl)imidazol-1-yl]methyl]benzoate
| Molecular Formula | C17H17ClN2Na2O4 |
| Molecular Weight | 394.06723 g/mol |
| XLogP | -5.4087 |
| Topological Polar Surface Area (TPSA) | 98.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 394.06723 Da |
| Heavy Atoms | 26 |
| Complexity | 429.0 |
| SMILES | CCCCC1=NC(=C(N1CC2=CC=C(C=C2)C(=O)[O-])CC(=O)[O-])Cl.[Na+].[Na+] |
| InChIKey | CCYTUJPXAFHZHC-UHFFFAOYSA-L |
The XLogP value of -5.4087 indicates that Exp 6155 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 98.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Exp 6155. Following Lipinski's Rule of Five, Exp 6155 has 0 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 Exp 6155 is 121280-51-1.
The molecular formula of Exp 6155 is C17H17ClN2Na2O4.
The molecular weight of Exp 6155 is 394.06723 g/mol.
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