TL;DR: 2-(diethylamino)ethyl 5-methoxy-1,2-dimethyl-1H-indole-3-carboxylate (CAS 801173-28-4) is a chemical compound with molecular formula C18H26N2O3 and molecular weight 318.19434 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(diethylamino)ethyl 5-methoxy-1,2-dimethylindole-3-carboxylate
Also Known As: AB00538719-07, 2-(diethylamino)ethyl 5-methoxy-1,2-dimethyl-1H-indole-3-carboxylate, 2-diethylaminoethyl 5-methoxy-1,2-dimethylindole-3-carboxylate, 2-diethylaminoethyl 5-methoxy-1,2-dimethyl-indole-3-carboxylate, INDOLE-3-CARBOXYLIC ACID, 1,2-DIMETHYL-5-METHOXY-, 2-(DIETHYLAMINO)ETHYL ESTER,
| Molecular Formula | C18H26N2O3 |
| Molecular Weight | 318.19434 g/mol |
| XLogP | 3.0 |
| Topological Polar Surface Area (TPSA) | 43.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 318.19434 Da |
| Heavy Atoms | 23 |
| Complexity | 386.0 |
| SMILES | CCN(CC)CCOC(=O)C1=C(N(C2=C1C=C(C=C2)OC)C)C |
| InChIKey | LSOCQPVOIHPFPK-UHFFFAOYSA-N |
The XLogP value of 3.0 indicates that 2-(diethylamino)ethyl 5-methoxy-1,2-dimethyl-1H-indole-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.7 Ų, 2-(diethylamino)ethyl 5-methoxy-1,2-dimethyl-1H-indole-3-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(diethylamino)ethyl 5-methoxy-1,2-dimethyl-1H-indole-3-carboxylate has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2-(diethylamino)ethyl 5-methoxy-1,2-dimethyl-1H-indole-3-carboxylate is 801173-28-4.
The molecular formula of 2-(diethylamino)ethyl 5-methoxy-1,2-dimethyl-1H-indole-3-carboxylate is C18H26N2O3.
The molecular weight of 2-(diethylamino)ethyl 5-methoxy-1,2-dimethyl-1H-indole-3-carboxylate is 318.19434 g/mol.
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