3,8-Diazabicyclo(3.2.1)octane, 8-propionyl-3-styryl-
TL;DR: 3,8-Diazabicyclo(3.2.1)octane, 8-propionyl-3-styryl- (CAS 1798-71-6) is a chemical compound with molecular formula C17H22N2O and molecular weight 270.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[3-[(E)-2-phenylethenyl]-3,8-diazabicyclo[3.2.1]octan-8-yl]propan-1-one
Also Known As: 3,8-Diazabicyclo(3.2.1)octane, 8-propionyl-3-styryl-, 5-23-03-00470 (Beilstein Handbook Reference), 3-(2-Phenylvinyl)-8-propionyl-3,8-diazabicyclo(3.2.1)octane, 1-[3-[(E)-2-phenylethenyl]-3,8-diazabicyclo[3.2.1]octan-8-yl]propan-1-one, 8-Propionyl-3-(2-phenylethenyl)-3,8-diazabicyclo[3.2.1]octane
| Molecular Formula | C17H22N2O |
|---|---|
| Molecular Weight | 270.17 g/mol |
| LogP | 2.7425 |
| Topological Polar Surface Area | 23.55 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 270.17322 |
| Heavy Atoms | 20 |
| Complexity | 482.97128 |
Chemical Identifiers
| CAS Number | 1798-71-6 |
|---|---|
| SMILES | CCC(=O)N1C2CCC1CN(C2)/C=C/C3=CC=CC=C3 |
Product Overview
3,8-Diazabicyclo(3.2.1)octane, 8-propionyl-3-styryl- (CAS 1798-71-6), with molecular formula C17H22N2O and molecular weight 270.17 g/mol. IUPAC: 1-[3-[(E)-2-phenylethenyl]-3,8-diazabicyclo[3.2.1]octan-8-yl]propan-1-one.
Chemical Property Profile of 3,8-Diazabicyclo(3.2.1)octane, 8-propionyl-3-styryl-
Property Insights of 3,8-Diazabicyclo(3.2.1)octane, 8-propionyl-3-styryl-
The XLogP value of 2.7425 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,8-Diazabicyclo(3.2.1)octane, 8-propionyl-3-styryl-. With a topological polar surface area (TPSA) of 23.55 Ų, 3,8-Diazabicyclo(3.2.1)octane, 8-propionyl-3-styryl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,8-Diazabicyclo(3.2.1)octane, 8-propionyl-3-styryl- 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
Frequently Asked Questions
What is the CAS number of 3,8-Diazabicyclo(3.2.1)octane, 8-propionyl-3-styryl-?
The CAS number of 3,8-Diazabicyclo(3.2.1)octane, 8-propionyl-3-styryl- is 1798-71-6.
What is the molecular formula of 3,8-Diazabicyclo(3.2.1)octane, 8-propionyl-3-styryl-?
The molecular formula of 3,8-Diazabicyclo(3.2.1)octane, 8-propionyl-3-styryl- is C17H22N2O.
What is the molecular weight of 3,8-Diazabicyclo(3.2.1)octane, 8-propionyl-3-styryl-?
The molecular weight of 3,8-Diazabicyclo(3.2.1)octane, 8-propionyl-3-styryl- is 270.17 g/mol.
Where can I buy 3,8-Diazabicyclo(3.2.1)octane, 8-propionyl-3-styryl-?
You can request a quote for 3,8-Diazabicyclo(3.2.1)octane, 8-propionyl-3-styryl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,8-Diazabicyclo(3.2.1)octane, 8-propionyl-3-styryl-?
Yes, KEHONG BIO provides custom synthesis services for 3,8-Diazabicyclo(3.2.1)octane, 8-propionyl-3-styryl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.