TL;DR: 1H-Indole-4-carboxamide, N-(2-(3-((1,1-dimethylpropyl)amino)propoxy)phenyl)-, monohydrochloride (CAS 129323-57-5) is a chemical compound with molecular formula C23H30ClN3O2 and molecular weight 415.20267 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[2-[3-(2-methylbutan-2-ylamino)propoxy]phenyl]-1H-indole-4-carboxamide;hydrochloride
Also Known As: 1H-Indole-4-carboxamide, N-(2-(3-((1,1-dimethylpropyl)amino)propoxy)phenyl)-, monohydrochloride, N-(2-(3-(1,1-Dimethylpropylamino)propoxy)phenyl)-1H-indole-4-carboxamide hydrochloride, N-[2-[3-(2-methylbutan-2-ylamino)propoxy]phenyl]-1H-indole-4-carboxamide hydrochloride, N-(2-{3-[(2-Methylbutan-2-yl)amino]propoxy}phenyl)-1H-indole-4-carboxamide--hydrogen chloride (1/1)
| Molecular Formula | C23H30ClN3O2 |
| Molecular Weight | 415.20267 g/mol |
| XLogP | 5.3891 |
| Topological Polar Surface Area (TPSA) | 66.2 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 9 |
| Exact Mass | 415.20267 Da |
| Heavy Atoms | 29 |
| Complexity | 496.0 |
| SMILES | CCC(C)(C)NCCCOC1=CC=CC=C1NC(=O)C2=C3C=CNC3=CC=C2.Cl |
| InChIKey | LIIVNIPVMGGFIY-UHFFFAOYSA-N |
The XLogP value of 5.3891 indicates that 1H-Indole-4-carboxamide, N-(2-(3-((1,1-dimethylpropyl)amino)propoxy)phenyl)-, monohydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 1H-Indole-4-carboxamide, N-(2-(3-((1,1-dimethylpropyl)amino)propoxy)phenyl)-, monohydrochloride. Following Lipinski's Rule of Five, 1H-Indole-4-carboxamide, N-(2-(3-((1,1-dimethylpropyl)amino)propoxy)phenyl)-, monohydrochloride has 4 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 1H-Indole-4-carboxamide, N-(2-(3-((1,1-dimethylpropyl)amino)propoxy)phenyl)-, monohydrochloride is 129323-57-5.
The molecular formula of 1H-Indole-4-carboxamide, N-(2-(3-((1,1-dimethylpropyl)amino)propoxy)phenyl)-, monohydrochloride is C23H30ClN3O2.
The molecular weight of 1H-Indole-4-carboxamide, N-(2-(3-((1,1-dimethylpropyl)amino)propoxy)phenyl)-, monohydrochloride is 415.20267 g/mol.
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