3-(2-Diethylaminoethyl)-8-propionyl-3,8-diazabicyclo(3.2.1)octane dihydrochloride
TL;DR: 3-(2-Diethylaminoethyl)-8-propionyl-3,8-diazabicyclo(3.2.1)octane dihydrochloride (CAS 67196-22-9) is a chemical compound with molecular formula C15H31Cl2N3O and molecular weight 339.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[3-[2-(diethylamino)ethyl]-3,8-diazabicyclo[3.2.1]octan-8-yl]propan-1-one;dihydrochloride
Also Known As: 3-(2-Diethylaminoethyl)-8-propionyl-3,8-diazabicyclo(3.2.1)octane dihydrochloride, 3,8-Diazabicyclo(3.2.1)octane, 3-(2-diethylaminoethyl)-8-propionyl-, dihydrochloride, 1-[3-(2-diethylaminoethyl)-3,8-diazabicyclo[3.2.1]octan-8-yl]propan-1-one dihydrochloride, 3,8-Diazabicyclo[3.2.1]octane-3-ethanamine, N,N-diethyl-8-(1-oxopropyl)-, dihydrochloride, 1-{3-[2-(Diethylamino)ethyl]-3,8-diazabicyclo[3.2.1]octan-8-yl}propan-1-one--hydrogen chloride (1/2)
| Molecular Formula | C15H31Cl2N3O |
|---|---|
| Molecular Weight | 339.18 g/mol |
| LogP | 2.257 |
| Topological Polar Surface Area | 26.79 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 339.18442 |
| Heavy Atoms | 21 |
| Complexity | 299.29385 |
Chemical Identifiers
| CAS Number | 67196-22-9 |
|---|---|
| SMILES | CCC(=O)N1C2CCC1CN(C2)CCN(CC)CC.Cl.Cl |
Product Overview
3-(2-Diethylaminoethyl)-8-propionyl-3,8-diazabicyclo(3.2.1)octane dihydrochloride (CAS 67196-22-9), with molecular formula C15H31Cl2N3O and molecular weight 339.18 g/mol. IUPAC: 1-[3-[2-(diethylamino)ethyl]-3,8-diazabicyclo[3.2.1]octan-8-yl]propan-1-one;dihydrochloride.
Chemical Property Profile of 3-(2-Diethylaminoethyl)-8-propionyl-3,8-diazabicyclo(3.2.1)octane dihydrochloride
Property Insights of 3-(2-Diethylaminoethyl)-8-propionyl-3,8-diazabicyclo(3.2.1)octane dihydrochloride
The XLogP value of 2.257 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(2-Diethylaminoethyl)-8-propionyl-3,8-diazabicyclo(3.2.1)octane dihydrochloride. With a topological polar surface area (TPSA) of 26.79 Ų, 3-(2-Diethylaminoethyl)-8-propionyl-3,8-diazabicyclo(3.2.1)octane dihydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(2-Diethylaminoethyl)-8-propionyl-3,8-diazabicyclo(3.2.1)octane dihydrochloride has 0 hydrogen bond donor(s) and 3 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-(2-Diethylaminoethyl)-8-propionyl-3,8-diazabicyclo(3.2.1)octane dihydrochloride?
The CAS number of 3-(2-Diethylaminoethyl)-8-propionyl-3,8-diazabicyclo(3.2.1)octane dihydrochloride is 67196-22-9.
What is the molecular formula of 3-(2-Diethylaminoethyl)-8-propionyl-3,8-diazabicyclo(3.2.1)octane dihydrochloride?
The molecular formula of 3-(2-Diethylaminoethyl)-8-propionyl-3,8-diazabicyclo(3.2.1)octane dihydrochloride is C15H31Cl2N3O.
What is the molecular weight of 3-(2-Diethylaminoethyl)-8-propionyl-3,8-diazabicyclo(3.2.1)octane dihydrochloride?
The molecular weight of 3-(2-Diethylaminoethyl)-8-propionyl-3,8-diazabicyclo(3.2.1)octane dihydrochloride is 339.18 g/mol.
Where can I buy 3-(2-Diethylaminoethyl)-8-propionyl-3,8-diazabicyclo(3.2.1)octane dihydrochloride?
You can request a quote for 3-(2-Diethylaminoethyl)-8-propionyl-3,8-diazabicyclo(3.2.1)octane dihydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(2-Diethylaminoethyl)-8-propionyl-3,8-diazabicyclo(3.2.1)octane dihydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 3-(2-Diethylaminoethyl)-8-propionyl-3,8-diazabicyclo(3.2.1)octane dihydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.