![3,7-Bis(3-methylbutanoyl)-1,5-di(propan-2-yl)-3,7-diazabicyclo[3.3.1]nonan-9-one structure](/static/products/625/625079-22-3.png)
3,7-Bis(3-methylbutanoyl)-1,5-di(propan-2-yl)-3,7-diazabicyclo[3.3.1]nonan-9-one
TL;DR: 3,7-Bis(3-methylbutanoyl)-1,5-di(propan-2-yl)-3,7-diazabicyclo[3.3.1]nonan-9-one (CAS 625079-22-3) is a chemical compound with molecular formula C23H40N2O3 and molecular weight 392.30 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,7-bis(3-methylbutanoyl)-1,5-di(propan-2-yl)-3,7-diazabicyclo[3.3.1]nonan-9-one
Also Known As: BAS 03376282, 1,5-Diisopropyl-3,7-bis-(3-methyl-butyryl)-3,7-diaza-bicyclo[3.3.1]nonan-9-one, 3,7-bis(3-methylbutanoyl)-1,5-di(propan-2-yl)-3,7-diazabicyclo[3.3.1]nonan-9-one, 1,1'-((1s,5s)-1,5-diisopropyl-9-oxo-3,7-diazabicyclo[3.3.1]nonane-3,7-diyl)bis(3-methylbutan-1-one)
| Molecular Formula | C23H40N2O3 |
|---|---|
| Molecular Weight | 392.30 g/mol |
| LogP | 3.6169 |
| Topological Polar Surface Area | 57.69 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 392.3039 |
| Heavy Atoms | 28 |
| Complexity | 557.337 |
Chemical Identifiers
| CAS Number | 625079-22-3 |
|---|---|
| SMILES | CC(C)CC(=O)N1CC2(CN(CC(C1)(C2=O)C(C)C)C(=O)CC(C)C)C(C)C |
Product Overview
3,7-Bis(3-methylbutanoyl)-1,5-di(propan-2-yl)-3,7-diazabicyclo[3.3.1]nonan-9-one (CAS 625079-22-3), with molecular formula C23H40N2O3 and molecular weight 392.30 g/mol. IUPAC: 3,7-bis(3-methylbutanoyl)-1,5-di(propan-2-yl)-3,7-diazabicyclo[3.3.1]nonan-9-one.
Chemical Property Profile of 3,7-Bis(3-methylbutanoyl)-1,5-di(propan-2-yl)-3,7-diazabicyclo[3.3.1]nonan-9-one
Property Insights of 3,7-Bis(3-methylbutanoyl)-1,5-di(propan-2-yl)-3,7-diazabicyclo[3.3.1]nonan-9-one
The XLogP value of 3.6169 indicates that 3,7-Bis(3-methylbutanoyl)-1,5-di(propan-2-yl)-3,7-diazabicyclo[3.3.1]nonan-9-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.69 Ų, 3,7-Bis(3-methylbutanoyl)-1,5-di(propan-2-yl)-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-Bis(3-methylbutanoyl)-1,5-di(propan-2-yl)-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-Bis(3-methylbutanoyl)-1,5-di(propan-2-yl)-3,7-diazabicyclo[3.3.1]nonan-9-one?
The CAS number of 3,7-Bis(3-methylbutanoyl)-1,5-di(propan-2-yl)-3,7-diazabicyclo[3.3.1]nonan-9-one is 625079-22-3.
What is the molecular formula of 3,7-Bis(3-methylbutanoyl)-1,5-di(propan-2-yl)-3,7-diazabicyclo[3.3.1]nonan-9-one?
The molecular formula of 3,7-Bis(3-methylbutanoyl)-1,5-di(propan-2-yl)-3,7-diazabicyclo[3.3.1]nonan-9-one is C23H40N2O3.
What is the molecular weight of 3,7-Bis(3-methylbutanoyl)-1,5-di(propan-2-yl)-3,7-diazabicyclo[3.3.1]nonan-9-one?
The molecular weight of 3,7-Bis(3-methylbutanoyl)-1,5-di(propan-2-yl)-3,7-diazabicyclo[3.3.1]nonan-9-one is 392.30 g/mol.
Where can I buy 3,7-Bis(3-methylbutanoyl)-1,5-di(propan-2-yl)-3,7-diazabicyclo[3.3.1]nonan-9-one?
You can request a quote for 3,7-Bis(3-methylbutanoyl)-1,5-di(propan-2-yl)-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-Bis(3-methylbutanoyl)-1,5-di(propan-2-yl)-3,7-diazabicyclo[3.3.1]nonan-9-one?
Yes, KEHONG BIO provides custom synthesis services for 3,7-Bis(3-methylbutanoyl)-1,5-di(propan-2-yl)-3,7-diazabicyclo[3.3.1]nonan-9-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.