TL;DR: 1-[1H-Benzotriazol-1-yl(2-methoxy-3-methylphenyl)methyl]cyclohexanol (CAS 133350-00-2) is a chemical compound with molecular formula C21H25N3O2 and molecular weight 351.19467 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[benzotriazol-1-yl-(2-methoxy-3-methylphenyl)methyl]cyclohexan-1-ol
Also Known As: 1-[1H-Benzotriazol-1-yl(2-methoxy-3-methylphenyl)methyl]cyclohexanol, 1-[(1H-Benzotriazol-1-yl)(2-methoxy-3-methylphenyl)methyl]cyclohexan-1-ol, 1-[benzotriazol-1-yl-(2-methoxy-3-methyl-phenyl)methyl]cyclohexan-1-ol, 1-[benzotriazol-1-yl-(2-methoxy-3-methylphenyl)methyl]cyclohexan-1-ol
| Molecular Formula | C21H25N3O2 |
| Molecular Weight | 351.19467 g/mol |
| XLogP | 4.0 |
| Topological Polar Surface Area (TPSA) | 60.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 351.19467 Da |
| Heavy Atoms | 26 |
| Complexity | 468.0 |
| SMILES | CC1=C(C(=CC=C1)C(C2(CCCCC2)O)N3C4=CC=CC=C4N=N3)OC |
| InChIKey | UVAGYXKVURHSFU-UHFFFAOYSA-N |
The XLogP value of 4.0 indicates that 1-[1H-Benzotriazol-1-yl(2-methoxy-3-methylphenyl)methyl]cyclohexanol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[1H-Benzotriazol-1-yl(2-methoxy-3-methylphenyl)methyl]cyclohexanol. Following Lipinski's Rule of Five, 1-[1H-Benzotriazol-1-yl(2-methoxy-3-methylphenyl)methyl]cyclohexanol has 1 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-[1H-Benzotriazol-1-yl(2-methoxy-3-methylphenyl)methyl]cyclohexanol is 133350-00-2.
The molecular formula of 1-[1H-Benzotriazol-1-yl(2-methoxy-3-methylphenyl)methyl]cyclohexanol is C21H25N3O2.
The molecular weight of 1-[1H-Benzotriazol-1-yl(2-methoxy-3-methylphenyl)methyl]cyclohexanol is 351.19467 g/mol.
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