TL;DR: 1-[2-Methyl-1-(morpholin-4-yl)propyl]-1H-1,2,3-benzotriazole (CAS 122668-90-0) is a chemical compound with molecular formula C14H20N4O and molecular weight 260.1637 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-[1-(benzotriazol-1-yl)-2-methylpropyl]morpholine
Also Known As: starbld0013882, 1-[2-Methyl-1-(morpholin-4-yl)propyl]-1H-1,2,3-benzotriazole, 1-(1-Morpholino-2-methylpropyl)-1H-benzotriazole, 4-[1-(benzotriazol-1-yl)-2-methylpropyl]morpholine, 1-(2-methyl-1-morpholin-4-yl-propyl)benzotriazole
| Molecular Formula | C14H20N4O |
| Molecular Weight | 260.1637 g/mol |
| XLogP | 2.3 |
| Topological Polar Surface Area (TPSA) | 43.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 260.1637 Da |
| Heavy Atoms | 19 |
| Complexity | 293.0 |
| SMILES | CC(C)C(N1CCOCC1)N2C3=CC=CC=C3N=N2 |
| InChIKey | IGAJVRPHBHUXAP-UHFFFAOYSA-N |
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[2-Methyl-1-(morpholin-4-yl)propyl]-1H-1,2,3-benzotriazole. With a topological polar surface area (TPSA) of 43.2 Ų, 1-[2-Methyl-1-(morpholin-4-yl)propyl]-1H-1,2,3-benzotriazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[2-Methyl-1-(morpholin-4-yl)propyl]-1H-1,2,3-benzotriazole has 0 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-[2-Methyl-1-(morpholin-4-yl)propyl]-1H-1,2,3-benzotriazole is 122668-90-0.
The molecular formula of 1-[2-Methyl-1-(morpholin-4-yl)propyl]-1H-1,2,3-benzotriazole is C14H20N4O.
The molecular weight of 1-[2-Methyl-1-(morpholin-4-yl)propyl]-1H-1,2,3-benzotriazole is 260.1637 g/mol.
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