TL;DR: 7-Methyl-5-(2-methylhexan-2-yl)-[1,3]dioxolo[4,5-g]isoquinoline (CAS 17105-10-1) is a chemical compound with molecular formula C18H23NO2 and molecular weight 285.17288 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
7-methyl-5-(2-methylhexan-2-yl)-[1,3]dioxolo[4,5-g]isoquinoline
Also Known As: 7-methyl-5-(2-methylhexan-2-yl)-[1,3]dioxolo[4,5-g]isoquinoline, 7-methyl-5-(2-methylhexan-2-yl)[1,3]dioxolo[4,5-g]isoquinoline
| Molecular Formula | C18H23NO2 |
| Molecular Weight | 285.17288 g/mol |
| XLogP | 5.5 |
| Topological Polar Surface Area (TPSA) | 31.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 285.17288 Da |
| Heavy Atoms | 21 |
| Complexity | 357.0 |
| SMILES | CCCCC(C)(C)C1=NC(=CC2=CC3=C(C=C21)OCO3)C |
| InChIKey | YJMARFCQZPJJEC-UHFFFAOYSA-N |
The XLogP value of 5.5 indicates that 7-Methyl-5-(2-methylhexan-2-yl)-[1,3]dioxolo[4,5-g]isoquinoline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 31.4 Ų, 7-Methyl-5-(2-methylhexan-2-yl)-[1,3]dioxolo[4,5-g]isoquinoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7-Methyl-5-(2-methylhexan-2-yl)-[1,3]dioxolo[4,5-g]isoquinoline has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 7-Methyl-5-(2-methylhexan-2-yl)-[1,3]dioxolo[4,5-g]isoquinoline is 17105-10-1.
The molecular formula of 7-Methyl-5-(2-methylhexan-2-yl)-[1,3]dioxolo[4,5-g]isoquinoline is C18H23NO2.
The molecular weight of 7-Methyl-5-(2-methylhexan-2-yl)-[1,3]dioxolo[4,5-g]isoquinoline is 285.17288 g/mol.
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