TL;DR: 3-Amino-5,6-dimethoxyindan-1-one hydrochloride (CAS 148502-19-6) is a chemical compound with molecular formula C11H14ClNO3 and molecular weight 243.06622 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-amino-5,6-dimethoxy-2,3-dihydroinden-1-one;hydrochloride
Also Known As: 3-Amino-5,6-dimethoxyindan-1-one hydrochloride, EiM17-04066, 3-amino-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one hydrochloride, 3-amino-5,6-dimethoxy-indan-1-one;hydrochloride, 3-amino-5,6-dimethoxy-2,3-dihydroinden-1-one;hydrochloride
| Molecular Formula | C11H14ClNO3 |
| Molecular Weight | 243.06622 g/mol |
| XLogP | 1.7118 |
| Topological Polar Surface Area (TPSA) | 61.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 243.06622 Da |
| Heavy Atoms | 16 |
| Complexity | 256.0 |
| SMILES | COC1=C(C=C2C(=O)CC(C2=C1)N)OC.Cl |
| InChIKey | FIQTUIHMHYURGX-UHFFFAOYSA-N |
The XLogP value of 1.7118 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Amino-5,6-dimethoxyindan-1-one hydrochloride. The TPSA of 61.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Amino-5,6-dimethoxyindan-1-one hydrochloride. Following Lipinski's Rule of Five, 3-Amino-5,6-dimethoxyindan-1-one hydrochloride has 2 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 3-Amino-5,6-dimethoxyindan-1-one hydrochloride is 148502-19-6.
The molecular formula of 3-Amino-5,6-dimethoxyindan-1-one hydrochloride is C11H14ClNO3.
The molecular weight of 3-Amino-5,6-dimethoxyindan-1-one hydrochloride is 243.06622 g/mol.
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