TL;DR: 1H-Benzotriazole, 1-[1-(4-morpholinyl)ethyl]- (CAS 127865-14-9) is a chemical compound with molecular formula C12H16N4O and molecular weight 232.13242 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-[1-(benzotriazol-1-yl)ethyl]morpholine
Also Known As: 1-(1-morpholin-4-ylethyl)benzotriazole, 1-(1-Morpholinoethyl)-1H-benzotriazole, 4-[1-(benzotriazol-1-yl)ethyl]morpholine, 1H-Benzotriazole, 1-[1-(4-morpholinyl)ethyl]-, 1-[1-(morpholin-4-yl)ethyl]-1H-1,2,3-benzotriazole
| Molecular Formula | C12H16N4O |
| Molecular Weight | 232.13242 g/mol |
| XLogP | 1.4 |
| Topological Polar Surface Area (TPSA) | 43.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 232.13242 Da |
| Heavy Atoms | 17 |
| Complexity | 257.0 |
| SMILES | CC(N1CCOCC1)N2C3=CC=CC=C3N=N2 |
| InChIKey | VUNKWQIQBLPECK-UHFFFAOYSA-N |
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-Benzotriazole, 1-[1-(4-morpholinyl)ethyl]-. With a topological polar surface area (TPSA) of 43.2 Ų, 1H-Benzotriazole, 1-[1-(4-morpholinyl)ethyl]- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H-Benzotriazole, 1-[1-(4-morpholinyl)ethyl]- 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 1H-Benzotriazole, 1-[1-(4-morpholinyl)ethyl]- is 127865-14-9.
The molecular formula of 1H-Benzotriazole, 1-[1-(4-morpholinyl)ethyl]- is C12H16N4O.
The molecular weight of 1H-Benzotriazole, 1-[1-(4-morpholinyl)ethyl]- is 232.13242 g/mol.
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