![3,7-Dibutanoyl-1,5-dipropyl-3,7-diazabicyclo[3.3.1]nonan-9-one structure](/static/products/445/445262-04-4.png)
3,7-Dibutanoyl-1,5-dipropyl-3,7-diazabicyclo[3.3.1]nonan-9-one
TL;DR: 3,7-Dibutanoyl-1,5-dipropyl-3,7-diazabicyclo[3.3.1]nonan-9-one (CAS 445262-04-4) is a chemical compound with molecular formula C21H36N2O3 and molecular weight 364.27 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,7-di(butanoyl)-1,5-dipropyl-3,7-diazabicyclo[3.3.1]nonan-9-one
Also Known As: BAS 03376275, AL-281/40838114, 3,7-dibutanoyl-1,5-dipropyl-3,7-diazabicyclo[3.3.1]nonan-9-one, 3,7-Dibutyryl-1,5-dipropyl-3,7-diaza-bicyclo[3.3.1]nonan-9-one, 3,7-dibutyryl-1,5-dipropyl-3,7-diazabicyclo[3.3.1]nonan-9-one
| Molecular Formula | C21H36N2O3 |
|---|---|
| Molecular Weight | 364.27 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 57.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 364.27258 |
| Heavy Atoms | 26 |
| Complexity | 485.0 |
Chemical Identifiers
| CAS Number | 445262-04-4 |
|---|---|
| SMILES | CCCC(=O)N1CC2(CN(CC(C1)(C2=O)CCC)C(=O)CCC)CCC |
| InChIKey | VONBEHQKVXUETM-UHFFFAOYSA-N |
Product Overview
3,7-Dibutanoyl-1,5-dipropyl-3,7-diazabicyclo[3.3.1]nonan-9-one (CAS 445262-04-4), with molecular formula C21H36N2O3 and molecular weight 364.27 g/mol. IUPAC: 3,7-di(butanoyl)-1,5-dipropyl-3,7-diazabicyclo[3.3.1]nonan-9-one.
Chemical Property Profile of 3,7-Dibutanoyl-1,5-dipropyl-3,7-diazabicyclo[3.3.1]nonan-9-one
Property Insights of 3,7-Dibutanoyl-1,5-dipropyl-3,7-diazabicyclo[3.3.1]nonan-9-one
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,7-Dibutanoyl-1,5-dipropyl-3,7-diazabicyclo[3.3.1]nonan-9-one. With a topological polar surface area (TPSA) of 57.7 Ų, 3,7-Dibutanoyl-1,5-dipropyl-3,7-diazabicyclo[3.3.1]nonan-9-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,7-Dibutanoyl-1,5-dipropyl-3,7-diazabicyclo[3.3.1]nonan-9-one 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 3,7-Dibutanoyl-1,5-dipropyl-3,7-diazabicyclo[3.3.1]nonan-9-one?
The CAS number of 3,7-Dibutanoyl-1,5-dipropyl-3,7-diazabicyclo[3.3.1]nonan-9-one is 445262-04-4.
What is the molecular formula of 3,7-Dibutanoyl-1,5-dipropyl-3,7-diazabicyclo[3.3.1]nonan-9-one?
The molecular formula of 3,7-Dibutanoyl-1,5-dipropyl-3,7-diazabicyclo[3.3.1]nonan-9-one is C21H36N2O3.
What is the molecular weight of 3,7-Dibutanoyl-1,5-dipropyl-3,7-diazabicyclo[3.3.1]nonan-9-one?
The molecular weight of 3,7-Dibutanoyl-1,5-dipropyl-3,7-diazabicyclo[3.3.1]nonan-9-one is 364.27 g/mol.
Where can I buy 3,7-Dibutanoyl-1,5-dipropyl-3,7-diazabicyclo[3.3.1]nonan-9-one?
You can request a quote for 3,7-Dibutanoyl-1,5-dipropyl-3,7-diazabicyclo[3.3.1]nonan-9-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,7-Dibutanoyl-1,5-dipropyl-3,7-diazabicyclo[3.3.1]nonan-9-one?
Yes, KEHONG BIO provides custom synthesis services for 3,7-Dibutanoyl-1,5-dipropyl-3,7-diazabicyclo[3.3.1]nonan-9-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.