1,1'-(1,5-diethyl-9-hydroxy-3,7-diazabicyclo[3.3.1]nonane-3,7-diyl)dipropan-1-one
TL;DR: 1,1'-(1,5-diethyl-9-hydroxy-3,7-diazabicyclo[3.3.1]nonane-3,7-diyl)dipropan-1-one (CAS 496772-41-9) is a chemical compound with molecular formula C17H30N2O3 and molecular weight 310.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(1,5-diethyl-9-hydroxy-7-propanoyl-3,7-diazabicyclo[3.3.1]nonan-3-yl)propan-1-one
Also Known As: 1,1'-(1,5-diethyl-9-hydroxy-3,7-diazabicyclo[3.3.1]nonane-3,7-diyl)dipropan-1-one, 1-(1,5-diethyl-9-hydroxy-3-propanoyl-3,7-diazabicyclo[3.3.1]nonan-7-yl)propan-1-one, 1,1'-((1R,5S)-1,5-diethyl-9-hydroxy-3,7-diazabicyclo[3.3.1]nonane-3,7-diyl)bis(propan-1-one)
| Molecular Formula | C17H30N2O3 |
|---|---|
| Molecular Weight | 310.23 g/mol |
| LogP | 1.6445 |
| Topological Polar Surface Area | 60.85 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 310.22565 |
| Heavy Atoms | 22 |
| Complexity | 397.185 |
Chemical Identifiers
| CAS Number | 496772-41-9 |
|---|---|
| SMILES | CCC(=O)N1CC2(CN(CC(C1)(C2O)CC)C(=O)CC)CC |
Product Overview
1,1'-(1,5-diethyl-9-hydroxy-3,7-diazabicyclo[3.3.1]nonane-3,7-diyl)dipropan-1-one (CAS 496772-41-9), with molecular formula C17H30N2O3 and molecular weight 310.23 g/mol. IUPAC: 1-(1,5-diethyl-9-hydroxy-7-propanoyl-3,7-diazabicyclo[3.3.1]nonan-3-yl)propan-1-one.
Chemical Property Profile of 1,1'-(1,5-diethyl-9-hydroxy-3,7-diazabicyclo[3.3.1]nonane-3,7-diyl)dipropan-1-one
Property Insights of 1,1'-(1,5-diethyl-9-hydroxy-3,7-diazabicyclo[3.3.1]nonane-3,7-diyl)dipropan-1-one
The XLogP value of 1.6445 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,1'-(1,5-diethyl-9-hydroxy-3,7-diazabicyclo[3.3.1]nonane-3,7-diyl)dipropan-1-one. The TPSA of 60.85 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,1'-(1,5-diethyl-9-hydroxy-3,7-diazabicyclo[3.3.1]nonane-3,7-diyl)dipropan-1-one. Following Lipinski's Rule of Five, 1,1'-(1,5-diethyl-9-hydroxy-3,7-diazabicyclo[3.3.1]nonane-3,7-diyl)dipropan-1-one has 1 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 1,1'-(1,5-diethyl-9-hydroxy-3,7-diazabicyclo[3.3.1]nonane-3,7-diyl)dipropan-1-one?
The CAS number of 1,1'-(1,5-diethyl-9-hydroxy-3,7-diazabicyclo[3.3.1]nonane-3,7-diyl)dipropan-1-one is 496772-41-9.
What is the molecular formula of 1,1'-(1,5-diethyl-9-hydroxy-3,7-diazabicyclo[3.3.1]nonane-3,7-diyl)dipropan-1-one?
The molecular formula of 1,1'-(1,5-diethyl-9-hydroxy-3,7-diazabicyclo[3.3.1]nonane-3,7-diyl)dipropan-1-one is C17H30N2O3.
What is the molecular weight of 1,1'-(1,5-diethyl-9-hydroxy-3,7-diazabicyclo[3.3.1]nonane-3,7-diyl)dipropan-1-one?
The molecular weight of 1,1'-(1,5-diethyl-9-hydroxy-3,7-diazabicyclo[3.3.1]nonane-3,7-diyl)dipropan-1-one is 310.23 g/mol.
Where can I buy 1,1'-(1,5-diethyl-9-hydroxy-3,7-diazabicyclo[3.3.1]nonane-3,7-diyl)dipropan-1-one?
You can request a quote for 1,1'-(1,5-diethyl-9-hydroxy-3,7-diazabicyclo[3.3.1]nonane-3,7-diyl)dipropan-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,1'-(1,5-diethyl-9-hydroxy-3,7-diazabicyclo[3.3.1]nonane-3,7-diyl)dipropan-1-one?
Yes, KEHONG BIO provides custom synthesis services for 1,1'-(1,5-diethyl-9-hydroxy-3,7-diazabicyclo[3.3.1]nonane-3,7-diyl)dipropan-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.