TL;DR: 2,6-Methano-3-benzazocine, 1,2,3,4,5,6-hexahydro-3,6-dimethyl-1-hydroxy- (CAS 101771-74-8) is a chemical compound with molecular formula C14H19NO and molecular weight 217.14667 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1,10-dimethyl-10-azatricyclo[7.3.1.02,7]trideca-2,4,6-trien-8-ol
Also Known As: 2,5-Dimethyl-8-hydroxy-6:7-benzomorphan, 2,6-Methano-3-benzazocine, 1,2,3,4,5,6-hexahydro-3,6-dimethyl-1-hydroxy-, 3,6-Dimethyl-1-hydroxy-1,2,3,4,5,6-hexahydro-2,6-methano-3-benzazocine, 3,6-Dimethyl-1,2,3,4,5,6-hexahydro-2,6-methano-3-benzazocin-1-ol, 1,10-dimethyl-10-azatricyclo[7.3.1.02,7]trideca-2,4,6-trien-8-ol
| Molecular Formula | C14H19NO |
| Molecular Weight | 217.14667 g/mol |
| XLogP | 2.0 |
| Topological Polar Surface Area (TPSA) | 23.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 217.14667 Da |
| Heavy Atoms | 16 |
| Complexity | 280.0 |
| SMILES | CC12CCN(C(C1)C(C3=CC=CC=C23)O)C |
| InChIKey | XOKVWXOJBKCDAF-UHFFFAOYSA-N |
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,6-Methano-3-benzazocine, 1,2,3,4,5,6-hexahydro-3,6-dimethyl-1-hydroxy-. With a topological polar surface area (TPSA) of 23.5 Ų, 2,6-Methano-3-benzazocine, 1,2,3,4,5,6-hexahydro-3,6-dimethyl-1-hydroxy- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,6-Methano-3-benzazocine, 1,2,3,4,5,6-hexahydro-3,6-dimethyl-1-hydroxy- has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2,6-Methano-3-benzazocine, 1,2,3,4,5,6-hexahydro-3,6-dimethyl-1-hydroxy- is 101771-74-8.
The molecular formula of 2,6-Methano-3-benzazocine, 1,2,3,4,5,6-hexahydro-3,6-dimethyl-1-hydroxy- is C14H19NO.
The molecular weight of 2,6-Methano-3-benzazocine, 1,2,3,4,5,6-hexahydro-3,6-dimethyl-1-hydroxy- is 217.14667 g/mol.
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