TL;DR: (+)-2alpha-Tropan-2-ol, (+-)-2-cyclopentyl-2-phenylglycolate (CAS 74051-42-6) is a chemical compound with molecular formula C21H29NO3 and molecular weight 343.21475 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(8-methyl-8-azabicyclo[3.2.1]octan-2-yl) 2-cyclopentyl-2-hydroxy-2-phenylacetate
Also Known As: (+)-2alpha-Tropan-2-ol, (+-)-2-cyclopentyl-2-phenylglycolate, (+)-2-alpha-Tropan-2-ol, (+-)-2-cyclopentyl-2-phenylglycolate, (+)-2.alpha.-Tropan-2-ol, (+-)-2-cyclopentyl-2-phenylglycolate, (8-methyl-8-azabicyclo[3.2.1]octan-4-yl) 2-cyclopentyl-2-hyd, benzeneacetic acid,
| Molecular Formula | C21H29NO3 |
| Molecular Weight | 343.21475 g/mol |
| XLogP | 4.0 |
| Topological Polar Surface Area (TPSA) | 49.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 343.21475 Da |
| Heavy Atoms | 25 |
| Complexity | 484.0 |
| SMILES | CN1C2CCC1C(CC2)OC(=O)C(C3CCCC3)(C4=CC=CC=C4)O |
| InChIKey | LZCYWXGWYVKLRQ-UHFFFAOYSA-N |
The XLogP value of 4.0 indicates that (+)-2alpha-Tropan-2-ol, (+-)-2-cyclopentyl-2-phenylglycolate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.8 Ų, (+)-2alpha-Tropan-2-ol, (+-)-2-cyclopentyl-2-phenylglycolate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (+)-2alpha-Tropan-2-ol, (+-)-2-cyclopentyl-2-phenylglycolate 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 (+)-2alpha-Tropan-2-ol, (+-)-2-cyclopentyl-2-phenylglycolate is 74051-42-6.
The molecular formula of (+)-2alpha-Tropan-2-ol, (+-)-2-cyclopentyl-2-phenylglycolate is C21H29NO3.
The molecular weight of (+)-2alpha-Tropan-2-ol, (+-)-2-cyclopentyl-2-phenylglycolate is 343.21475 g/mol.
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