![1-Methyl-3,7-bis(4-nitrobenzoyl)-5-propyl-3,7-diazabicyclo[3.3.1]nonan-9-one structure](/static/products/799/799808-85-8.png)
1-Methyl-3,7-bis(4-nitrobenzoyl)-5-propyl-3,7-diazabicyclo[3.3.1]nonan-9-one
TL;DR: 1-Methyl-3,7-bis(4-nitrobenzoyl)-5-propyl-3,7-diazabicyclo[3.3.1]nonan-9-one (CAS 799808-85-8) is a chemical compound with molecular formula C25H26N4O7 and molecular weight 494.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methyl-3,7-bis(4-nitrobenzoyl)-5-propyl-3,7-diazabicyclo[3.3.1]nonan-9-one
Also Known As: 1-methyl-3,7-bis(4-nitrobenzoyl)-5-propyl-3,7-diazabicyclo[3.3.1]nonan-9-one, 1-Methyl-3,7-bis-(4-nitro-benzoyl)-5-propyl-3,7-diaza-bicyclo[3.3.1]nonan-9-one, 1-methyl-3,7-bis[(4-nitrophenyl)carbonyl]-5-propyl-3,7-diazabicyclo[3.3.1]nonan-9-one, 1-methyl-3,7-bis[(4-nitrophenyl)-oxomethyl]-5-propyl-3,7-diazabicyclo[3.3.1]nonan-9-one, 5-methyl-3,7-bis(4-nitrobenzoyl)-1-propyl-3,7-diazabicyclo[3.3.1]nonan-9-one
| Molecular Formula | C25H26N4O7 |
|---|---|
| Molecular Weight | 494.18 g/mol |
| LogP | 3.4767 |
| Topological Polar Surface Area | 143.97 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 494.18015 |
| Heavy Atoms | 36 |
| Complexity | 1158.559 |
Chemical Identifiers
| CAS Number | 799808-85-8 |
|---|---|
| SMILES | CCCC12CN(CC(C1=O)(CN(C2)C(=O)C3=CC=C(C=C3)[N+](=O)[O-])C)C(=O)C4=CC=C(C=C4)[N+](=O)[O-] |
Product Overview
1-Methyl-3,7-bis(4-nitrobenzoyl)-5-propyl-3,7-diazabicyclo[3.3.1]nonan-9-one (CAS 799808-85-8), with molecular formula C25H26N4O7 and molecular weight 494.18 g/mol. IUPAC: 1-methyl-3,7-bis(4-nitrobenzoyl)-5-propyl-3,7-diazabicyclo[3.3.1]nonan-9-one.
Chemical Property Profile of 1-Methyl-3,7-bis(4-nitrobenzoyl)-5-propyl-3,7-diazabicyclo[3.3.1]nonan-9-one
Property Insights of 1-Methyl-3,7-bis(4-nitrobenzoyl)-5-propyl-3,7-diazabicyclo[3.3.1]nonan-9-one
The XLogP value of 3.4767 indicates that 1-Methyl-3,7-bis(4-nitrobenzoyl)-5-propyl-3,7-diazabicyclo[3.3.1]nonan-9-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 143.97 Ų indicates high polarity, suggesting 1-Methyl-3,7-bis(4-nitrobenzoyl)-5-propyl-3,7-diazabicyclo[3.3.1]nonan-9-one may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1-Methyl-3,7-bis(4-nitrobenzoyl)-5-propyl-3,7-diazabicyclo[3.3.1]nonan-9-one has 0 hydrogen bond donor(s) and 7 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-Methyl-3,7-bis(4-nitrobenzoyl)-5-propyl-3,7-diazabicyclo[3.3.1]nonan-9-one?
The CAS number of 1-Methyl-3,7-bis(4-nitrobenzoyl)-5-propyl-3,7-diazabicyclo[3.3.1]nonan-9-one is 799808-85-8.
What is the molecular formula of 1-Methyl-3,7-bis(4-nitrobenzoyl)-5-propyl-3,7-diazabicyclo[3.3.1]nonan-9-one?
The molecular formula of 1-Methyl-3,7-bis(4-nitrobenzoyl)-5-propyl-3,7-diazabicyclo[3.3.1]nonan-9-one is C25H26N4O7.
What is the molecular weight of 1-Methyl-3,7-bis(4-nitrobenzoyl)-5-propyl-3,7-diazabicyclo[3.3.1]nonan-9-one?
The molecular weight of 1-Methyl-3,7-bis(4-nitrobenzoyl)-5-propyl-3,7-diazabicyclo[3.3.1]nonan-9-one is 494.18 g/mol.
Where can I buy 1-Methyl-3,7-bis(4-nitrobenzoyl)-5-propyl-3,7-diazabicyclo[3.3.1]nonan-9-one?
You can request a quote for 1-Methyl-3,7-bis(4-nitrobenzoyl)-5-propyl-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 1-Methyl-3,7-bis(4-nitrobenzoyl)-5-propyl-3,7-diazabicyclo[3.3.1]nonan-9-one?
Yes, KEHONG BIO provides custom synthesis services for 1-Methyl-3,7-bis(4-nitrobenzoyl)-5-propyl-3,7-diazabicyclo[3.3.1]nonan-9-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.