TL;DR: ethyl 3-(2-(2,4-dichlorophenoxy)acetamido)-1H-indole-2-carboxylate (CAS 850929-53-2) is a chemical compound with molecular formula C19H16Cl2N2O4 and molecular weight 406.0487 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl 3-[[2-(2,4-dichlorophenoxy)acetyl]amino]-1H-indole-2-carboxylate
Also Known As: ethyl 3-(2-(2,4-dichlorophenoxy)acetamido)-1H-indole-2-carboxylate, F0588-0118, ethyl 3-[[2-(2,4-dichlorophenoxy)acetyl]amino]-1H-indole-2-carboxylate, ETHYL 3-[2-(2,4-DICHLOROPHENOXY)ACETAMIDO]-1H-INDOLE-2-CARBOXYLATE
| Molecular Formula | C19H16Cl2N2O4 |
| Molecular Weight | 406.0487 g/mol |
| XLogP | 5.3 |
| Topological Polar Surface Area (TPSA) | 80.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 406.0487 Da |
| Heavy Atoms | 27 |
| Complexity | 536.0 |
| SMILES | CCOC(=O)C1=C(C2=CC=CC=C2N1)NC(=O)COC3=C(C=C(C=C3)Cl)Cl |
| InChIKey | GTRUCBGFVSXGRO-UHFFFAOYSA-N |
The XLogP value of 5.3 indicates that ethyl 3-(2-(2,4-dichlorophenoxy)acetamido)-1H-indole-2-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.4 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 3-(2-(2,4-dichlorophenoxy)acetamido)-1H-indole-2-carboxylate. Following Lipinski's Rule of Five, ethyl 3-(2-(2,4-dichlorophenoxy)acetamido)-1H-indole-2-carboxylate has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of ethyl 3-(2-(2,4-dichlorophenoxy)acetamido)-1H-indole-2-carboxylate is 850929-53-2.
The molecular formula of ethyl 3-(2-(2,4-dichlorophenoxy)acetamido)-1H-indole-2-carboxylate is C19H16Cl2N2O4.
The molecular weight of ethyl 3-(2-(2,4-dichlorophenoxy)acetamido)-1H-indole-2-carboxylate is 406.0487 g/mol.
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