TL;DR: 1-((1,1-Dimethylethyl)amino)-3-((5a,6,7,8,9,9a-hexahydro-2-dibenzofuranyl)oxy)-2-propanol HCl (CAS 119952-83-9) is a chemical compound with molecular formula C19H30ClNO3 and molecular weight 355.1914 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(5a,6,7,8,9,9a-hexahydrodibenzofuran-2-yloxy)-3-(tert-butylamino)propan-2-ol;hydrochloride
Also Known As: 1-((1,1-Dimethylethyl)amino)-3-((5a,6,7,8,9,9a-hexahydro-2-dibenzofuranyl)oxy)-2-propanol HCl, 2-Propanol, 1-((1,1-dimethylethyl)amino)-3-((5a,6,7,8,9,9a-hexahydro-2-dibenzofuranyl)oxy)-, hydrochloride, 1-(5a,6,7,8,9,9a-hexahydrodibenzofuran-2-yloxy)-3-(tert-butylamino)propan-2-ol hydrochloride, 1-(tert-Butylamino)-3-[(5a,6,7,8,9,9a-hexahydrodibenzo[b,d]furan-2-yl)oxy]propan-2-ol--hydrogen chloride (1/1)
| Molecular Formula | C19H30ClNO3 |
| Molecular Weight | 355.1914 g/mol |
| XLogP | 3.6548 |
| Topological Polar Surface Area (TPSA) | 50.7 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 355.1914 Da |
| Heavy Atoms | 24 |
| Complexity | 381.0 |
| SMILES | CC(C)(C)NCC(COC1=CC2=C(C=C1)OC3C2CCCC3)O.Cl |
| InChIKey | OHWFLFIMJTUVJC-UHFFFAOYSA-N |
The XLogP value of 3.6548 indicates that 1-((1,1-Dimethylethyl)amino)-3-((5a,6,7,8,9,9a-hexahydro-2-dibenzofuranyl)oxy)-2-propanol HCl is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.7 Ų, 1-((1,1-Dimethylethyl)amino)-3-((5a,6,7,8,9,9a-hexahydro-2-dibenzofuranyl)oxy)-2-propanol HCl exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-((1,1-Dimethylethyl)amino)-3-((5a,6,7,8,9,9a-hexahydro-2-dibenzofuranyl)oxy)-2-propanol HCl has 3 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 1-((1,1-Dimethylethyl)amino)-3-((5a,6,7,8,9,9a-hexahydro-2-dibenzofuranyl)oxy)-2-propanol HCl is 119952-83-9.
The molecular formula of 1-((1,1-Dimethylethyl)amino)-3-((5a,6,7,8,9,9a-hexahydro-2-dibenzofuranyl)oxy)-2-propanol HCl is C19H30ClNO3.
The molecular weight of 1-((1,1-Dimethylethyl)amino)-3-((5a,6,7,8,9,9a-hexahydro-2-dibenzofuranyl)oxy)-2-propanol HCl is 355.1914 g/mol.
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