3-Diphenylmethyl-8-propionyl-3,8-diazabicyclo(3.2.1)octane
TL;DR: 3-Diphenylmethyl-8-propionyl-3,8-diazabicyclo(3.2.1)octane (CAS 63977-68-4) is a chemical compound with molecular formula C22H26N2O and molecular weight 334.2045 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(3-benzhydryl-3,8-diazabicyclo[3.2.1]octan-8-yl)propan-1-one
Also Known As: KST-1B6986, diethyl-methyl-phenylazanium bromide, 3-Diphenylmethyl-8-propionyl-3,8-diazabicyclo(3.2.1)octane, 3-Diphenylmethyl-8-propionyl-3,8-diazabicyclo[3.2.1]octane, 5-23-03-00471 (Beilstein Handbook Reference)
Technical Specifications
| Molecular Formula | C22H26N2O |
| Molecular Weight | 334.2045 g/mol |
| XLogP | 3.8 |
| Topological Polar Surface Area (TPSA) | 23.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 334.2045 Da |
| Heavy Atoms | 25 |
| Complexity | 421.0 |
| SMILES | CCC(=O)N1C2CCC1CN(C2)C(C3=CC=CC=C3)C4=CC=CC=C4 |
| InChIKey | SHAYUWBGXZREDN-UHFFFAOYSA-N |
Chemical Property Profile of 3-Diphenylmethyl-8-propionyl-3,8-diazabicyclo(3.2.1)octane
Property Insights of 3-Diphenylmethyl-8-propionyl-3,8-diazabicyclo(3.2.1)octane
The XLogP value of 3.8 indicates that 3-Diphenylmethyl-8-propionyl-3,8-diazabicyclo(3.2.1)octane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 23.6 Ų, 3-Diphenylmethyl-8-propionyl-3,8-diazabicyclo(3.2.1)octane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Diphenylmethyl-8-propionyl-3,8-diazabicyclo(3.2.1)octane 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 3-Diphenylmethyl-8-propionyl-3,8-diazabicyclo(3.2.1)octane?
The CAS number of 3-Diphenylmethyl-8-propionyl-3,8-diazabicyclo(3.2.1)octane is 63977-68-4.
What is the molecular formula of 3-Diphenylmethyl-8-propionyl-3,8-diazabicyclo(3.2.1)octane?
The molecular formula of 3-Diphenylmethyl-8-propionyl-3,8-diazabicyclo(3.2.1)octane is C22H26N2O.
What is the molecular weight of 3-Diphenylmethyl-8-propionyl-3,8-diazabicyclo(3.2.1)octane?
The molecular weight of 3-Diphenylmethyl-8-propionyl-3,8-diazabicyclo(3.2.1)octane is 334.2045 g/mol.
Where can I buy 3-Diphenylmethyl-8-propionyl-3,8-diazabicyclo(3.2.1)octane?
You can request a quote for 3-Diphenylmethyl-8-propionyl-3,8-diazabicyclo(3.2.1)octane directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-Diphenylmethyl-8-propionyl-3,8-diazabicyclo(3.2.1)octane?
Yes, CoreyChem provides custom synthesis services for 3-Diphenylmethyl-8-propionyl-3,8-diazabicyclo(3.2.1)octane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.