TL;DR: 1-[(2-Methoxynaphthalen-1-yl)methyl]-1H-1,2,3-benzotriazole (CAS 133349-89-0) is a chemical compound with molecular formula C18H15N3O and molecular weight 289.12152 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[(2-methoxynaphthalen-1-yl)methyl]benzotriazole
Also Known As: starbld0029619, 1-[(2-Methoxynaphthalen-1-yl)methyl]-1H-1,2,3-benzotriazole, 1-[(2-methoxynaphthalen-1-yl)methyl]benzotriazole, 1-[(2-methoxy-1-naphthyl)methyl]benzotriazole, 1-((2-Methoxynaphthalen-1-yl)methyl)-1H-benzo[d][1,2,3]triazole
| Molecular Formula | C18H15N3O |
| Molecular Weight | 289.12152 g/mol |
| XLogP | 3.9 |
| Topological Polar Surface Area (TPSA) | 39.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 289.12152 Da |
| Heavy Atoms | 22 |
| Complexity | 377.0 |
| SMILES | COC1=C(C2=CC=CC=C2C=C1)CN3C4=CC=CC=C4N=N3 |
| InChIKey | FVWZFGGYHRVVEO-UHFFFAOYSA-N |
The XLogP value of 3.9 indicates that 1-[(2-Methoxynaphthalen-1-yl)methyl]-1H-1,2,3-benzotriazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 39.9 Ų, 1-[(2-Methoxynaphthalen-1-yl)methyl]-1H-1,2,3-benzotriazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[(2-Methoxynaphthalen-1-yl)methyl]-1H-1,2,3-benzotriazole has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 1-[(2-Methoxynaphthalen-1-yl)methyl]-1H-1,2,3-benzotriazole is 133349-89-0.
The molecular formula of 1-[(2-Methoxynaphthalen-1-yl)methyl]-1H-1,2,3-benzotriazole is C18H15N3O.
The molecular weight of 1-[(2-Methoxynaphthalen-1-yl)methyl]-1H-1,2,3-benzotriazole is 289.12152 g/mol.
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