TL;DR: Indole, 5-benzyloxy-3-(2-dimethylaminoethyl)-, oxalate (CAS 101832-88-6) is a chemical compound with molecular formula C21H24N2O5 and molecular weight 384.16852 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
dimethyl-[2-(5-phenylmethoxy-1H-indol-3-yl)ethyl]azanium;2-hydroxy-2-oxoacetate
Also Known As: 5-Benzyloxy-N,N-dimethyltryptamine oxalate, Tryptamine, 5-benzyloxy-N,N-dimethyl-, oxalate, INDOLE, 5-BENZYLOXY-3-(2-DIMETHYLAMINOETHYL)-, OXALATE, Tryptamine,5-benzyloxy-N,N-dimethyl-,oxalate, dimethyl-[2-(5-phenylmethoxy-1H-indol-3-yl)ethyl]azanium;2-hydroxy-2-oxoacetate
| Molecular Formula | C21H24N2O5 |
| Molecular Weight | 384.16852 g/mol |
| XLogP | 0.25 |
| Topological Polar Surface Area (TPSA) | 107.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 384.16852 Da |
| Heavy Atoms | 28 |
| Complexity | 405.0 |
| SMILES | C[NH+](C)CCC1=CNC2=C1C=C(C=C2)OCC3=CC=CC=C3.C(=O)(C(=O)[O-])O |
| InChIKey | NOFCFKLTAPSEQJ-UHFFFAOYSA-N |
The XLogP value of 0.25 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Indole, 5-benzyloxy-3-(2-dimethylaminoethyl)-, oxalate. The TPSA of 107.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Indole, 5-benzyloxy-3-(2-dimethylaminoethyl)-, oxalate. Following Lipinski's Rule of Five, Indole, 5-benzyloxy-3-(2-dimethylaminoethyl)-, oxalate 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 Indole, 5-benzyloxy-3-(2-dimethylaminoethyl)-, oxalate is 101832-88-6.
The molecular formula of Indole, 5-benzyloxy-3-(2-dimethylaminoethyl)-, oxalate is C21H24N2O5.
The molecular weight of Indole, 5-benzyloxy-3-(2-dimethylaminoethyl)-, oxalate is 384.16852 g/mol.
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