2-Propanoyl-3-(4-tolyl)tropane
TL;DR: 2-Propanoyl-3-(4-tolyl)tropane (CAS 152783-29-4) is a chemical compound with molecular formula C18H25NO and molecular weight 271.1936 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[(1R,2S,3S,5S)-8-methyl-3-(4-methylphenyl)-8-azabicyclo[3.2.1]octan-2-yl]propan-1-one
Also Known As: 2-Propanoyl-3-(4-tolyl)tropane, 2-PTT, 2-Propanoyl-3-(4-toluyl)tropane, 2beta-Propanoyl-3beta-(4-tolyl)tropane, 2beta-propanoyl-3beta-(4-tolyl)-tropane
Technical Specifications
| Molecular Formula | C18H25NO |
| Molecular Weight | 271.1936 g/mol |
| XLogP | 3.3 |
| Topological Polar Surface Area (TPSA) | 20.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 271.1936 Da |
| Heavy Atoms | 20 |
| Complexity | 358.0 |
| SMILES | CCC(=O)[C@@H]1[C@H]2CC[C@H](N2C)C[C@@H]1C3=CC=C(C=C3)C |
| InChIKey | PZEAJTAVRYLBTK-LHHMISFZSA-N |
Chemical Property Profile of 2-Propanoyl-3-(4-tolyl)tropane
Property Insights of 2-Propanoyl-3-(4-tolyl)tropane
The XLogP value of 3.3 indicates that 2-Propanoyl-3-(4-tolyl)tropane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.3 Ų, 2-Propanoyl-3-(4-tolyl)tropane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Propanoyl-3-(4-tolyl)tropane has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-Propanoyl-3-(4-tolyl)tropane?
The CAS number of 2-Propanoyl-3-(4-tolyl)tropane is 152783-29-4.
What is the molecular formula of 2-Propanoyl-3-(4-tolyl)tropane?
The molecular formula of 2-Propanoyl-3-(4-tolyl)tropane is C18H25NO.
What is the molecular weight of 2-Propanoyl-3-(4-tolyl)tropane?
The molecular weight of 2-Propanoyl-3-(4-tolyl)tropane is 271.1936 g/mol.
Where can I buy 2-Propanoyl-3-(4-tolyl)tropane?
You can request a quote for 2-Propanoyl-3-(4-tolyl)tropane directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Propanoyl-3-(4-tolyl)tropane?
Yes, CoreyChem provides custom synthesis services for 2-Propanoyl-3-(4-tolyl)tropane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.