TL;DR: RefChem:239149 (CAS 112857-84-8) is a chemical compound with molecular formula C24H29N3O7 and molecular weight 471.20056 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[2-[3-(tert-butylamino)-2-hydroxypropoxy]phenyl]-1H-indole-4-carboxamide;oxalic acid
Also Known As: N-(2-(3-((1,1-Dimethylethyl)amino)-2-hydroxypropoxy)phenyl)-1H-indol-4-carboxamide oxalate, 1H-Indole-4-carboxamide, N-(2-(3-((1,1-dimethylethyl)amino)-2-hydroxypropoxy)phenyl)-, ethanedioate (salt), N-[2-[3-(tert-butylamino)-2-hydroxypropoxy]phenyl]-1H-indole-4-carboxamide,oxalic acid, N-[2-[3-(tert-butylamino)-2-hydroxypropoxy]phenyl]-1H-indole-4-carboxamide; oxalic acid, N-[2-[2-HYDROXY-3-(TERT-BUTYLAMINO)PROPOXY]PHENYL]-1H-INDOLE-4-CARBOXAMIDE; OXALIC ACID
| Molecular Formula | C24H29N3O7 |
| Molecular Weight | 471.20056 g/mol |
| XLogP | 2.7036 |
| Topological Polar Surface Area (TPSA) | 161.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 9 |
| Exact Mass | 471.20056 Da |
| Heavy Atoms | 34 |
| Complexity | 579.0 |
| SMILES | CC(C)(C)NCC(COC1=CC=CC=C1NC(=O)C2=C3C=CNC3=CC=C2)O.C(=O)(C(=O)O)O |
| InChIKey | ZOKPGTGCXAQYHX-UHFFFAOYSA-N |
The XLogP value of 2.7036 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:239149. The TPSA of 161.0 Ų indicates high polarity, suggesting RefChem:239149 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:239149 has 6 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of RefChem:239149 is 112857-84-8.
The molecular formula of RefChem:239149 is C24H29N3O7.
The molecular weight of RefChem:239149 is 471.20056 g/mol.
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