TL;DR: RefChem:268693 (CAS 37391-17-6) is a chemical compound with molecular formula C22H26N2O5 and molecular weight 398.18417 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
dimethyl-[3-(3-methyl-2-oxo-3-phenylindol-1-yl)propyl]azanium;2-hydroxy-2-oxoacetate
Also Known As: 1,3-Dihydro-1-(3-(dimethylamino)propyl)-3-methyl-3-phenyl-2H-indol-2-one oxalate, 2H-Indol-2-one, 1,3-dihydro-1-(3-(dimethylamino)propyl)-3-methyl-3-phenyl-, oxalate (1:1), dimethyl-[3-(3-methyl-2-oxo-3-phenylindol-1-yl)propyl]azanium;2-hydroxy-2-oxoacetate, dimethyl-[3-(3-methyl-2-oxo-3-phenylindol-1-yl)propyl]azanium; 2-hydroxy-2-oxoacetate
| Molecular Formula | C22H26N2O5 |
| Molecular Weight | 398.18417 g/mol |
| XLogP | -0.31 |
| Topological Polar Surface Area (TPSA) | 102.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 398.18417 Da |
| Heavy Atoms | 29 |
| Complexity | 494.0 |
| SMILES | CC1(C2=CC=CC=C2N(C1=O)CCC[NH+](C)C)C3=CC=CC=C3.C(=O)(C(=O)[O-])O |
| InChIKey | NSEDLDYHLBZXPR-UHFFFAOYSA-N |
The XLogP value of -0.31 indicates that RefChem:268693 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 102.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:268693. Following Lipinski's Rule of Five, RefChem:268693 has 2 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 RefChem:268693 is 37391-17-6.
The molecular formula of RefChem:268693 is C22H26N2O5.
The molecular weight of RefChem:268693 is 398.18417 g/mol.
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