(-)-2-alpha-Tropan-2-ol, (+)-2-cyclopentyl-2-phenylglycolate
TL;DR: (-)-2-alpha-Tropan-2-ol, (+)-2-cyclopentyl-2-phenylglycolate (CAS 64471-31-4) is a chemical compound with molecular formula C21H29NO3 and molecular weight 343.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(1S,2S,5S)-8-methyl-8-azabicyclo[3.2.1]octan-2-yl] (2S)-2-cyclopentyl-2-hydroxy-2-phenylacetate
Also Known As: (-)-2-alpha-Tropan-2-ol, (+)-2-cyclopentyl-2-phenylglycolate, [(1S,4S,5S)-8-methyl-8-azabicyclo[3.2.1]octan-4-yl] (2S)-2-cyclopentyl-2-hydroxy-2-phenylacetate, RefChem:1049059
| Molecular Formula | C21H29NO3 |
|---|---|
| Molecular Weight | 343.21 g/mol |
| LogP | 3.2328 |
| Topological Polar Surface Area | 49.77 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 343.21475 |
| Heavy Atoms | 25 |
| Complexity | 612.82697 |
Chemical Identifiers
| CAS Number | 64471-31-4 |
|---|---|
| SMILES | CN1[C@H]2CC[C@H]1[C@H](CC2)OC(=O)[C@](C3CCCC3)(C4=CC=CC=C4)O |
Product Overview
(-)-2-alpha-Tropan-2-ol, (+)-2-cyclopentyl-2-phenylglycolate (CAS 64471-31-4), with molecular formula C21H29NO3 and molecular weight 343.21 g/mol. IUPAC: [(1S,2S,5S)-8-methyl-8-azabicyclo[3.2.1]octan-2-yl] (2S)-2-cyclopentyl-2-hydroxy-2-phenylacetate.
Chemical Property Profile of (-)-2-alpha-Tropan-2-ol, (+)-2-cyclopentyl-2-phenylglycolate
Property Insights of (-)-2-alpha-Tropan-2-ol, (+)-2-cyclopentyl-2-phenylglycolate
The XLogP value of 3.2328 indicates that (-)-2-alpha-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 49.77 Ų, (-)-2-alpha-Tropan-2-ol, (+)-2-cyclopentyl-2-phenylglycolate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (-)-2-alpha-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.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (-)-2-alpha-Tropan-2-ol, (+)-2-cyclopentyl-2-phenylglycolate?
The CAS number of (-)-2-alpha-Tropan-2-ol, (+)-2-cyclopentyl-2-phenylglycolate is 64471-31-4.
What is the molecular formula of (-)-2-alpha-Tropan-2-ol, (+)-2-cyclopentyl-2-phenylglycolate?
The molecular formula of (-)-2-alpha-Tropan-2-ol, (+)-2-cyclopentyl-2-phenylglycolate is C21H29NO3.
What is the molecular weight of (-)-2-alpha-Tropan-2-ol, (+)-2-cyclopentyl-2-phenylglycolate?
The molecular weight of (-)-2-alpha-Tropan-2-ol, (+)-2-cyclopentyl-2-phenylglycolate is 343.21 g/mol.
Where can I buy (-)-2-alpha-Tropan-2-ol, (+)-2-cyclopentyl-2-phenylglycolate?
You can request a quote for (-)-2-alpha-Tropan-2-ol, (+)-2-cyclopentyl-2-phenylglycolate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (-)-2-alpha-Tropan-2-ol, (+)-2-cyclopentyl-2-phenylglycolate?
Yes, KEHONG BIO provides custom synthesis services for (-)-2-alpha-Tropan-2-ol, (+)-2-cyclopentyl-2-phenylglycolate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.