![6-({2-Nitrophenyl}sulfonyl)-1,3,3-trimethyl-6-azabicyclo[3.2.1]octane structure](/static/products/3058/305853-88-7.webp)
6-({2-Nitrophenyl}sulfonyl)-1,3,3-trimethyl-6-azabicyclo[3.2.1]octane
TL;DR: 6-({2-Nitrophenyl}sulfonyl)-1,3,3-trimethyl-6-azabicyclo[3.2.1]octane (CAS 305853-88-7) is a chemical compound with molecular formula C16H22N2O4S and molecular weight 338.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3,3-trimethyl-6-(2-nitrophenyl)sulfonyl-6-azabicyclo[3.2.1]octane
Also Known As: AE-641/14413046, 6-({2-nitrophenyl}sulfonyl)-1,3,3-trimethyl-6-azabicyclo[3.2.1]octane, 1,3,3-Trimethyl-6-(2-nitrobenzene-1-sulfonyl)-6-azabicyclo[3.2.1]octane, 1,3,3-trimethyl-6-(2-nitrophenyl)sulfonyl-6-azabicyclo[3.2.1]octane, 1,3,3-trimethyl-6-[(2-nitrophenyl)sulfonyl]-6-azabicyclo[3.2.1]octane
| Molecular Formula | C16H22N2O4S |
|---|---|
| Molecular Weight | 338.13 g/mol |
| LogP | 3.1841 |
| Topological Polar Surface Area | 80.52 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 338.13004 |
| Heavy Atoms | 23 |
| Complexity | 759.0987 |
Chemical Identifiers
| CAS Number | 305853-88-7 |
|---|---|
| SMILES | CC1(CC2CC(C1)(CN2S(=O)(=O)C3=CC=CC=C3[N+](=O)[O-])C)C |
Product Overview
6-({2-Nitrophenyl}sulfonyl)-1,3,3-trimethyl-6-azabicyclo[3.2.1]octane (CAS 305853-88-7), with molecular formula C16H22N2O4S and molecular weight 338.13 g/mol. IUPAC: 1,3,3-trimethyl-6-(2-nitrophenyl)sulfonyl-6-azabicyclo[3.2.1]octane.
Chemical Property Profile of 6-({2-Nitrophenyl}sulfonyl)-1,3,3-trimethyl-6-azabicyclo[3.2.1]octane
Property Insights of 6-({2-Nitrophenyl}sulfonyl)-1,3,3-trimethyl-6-azabicyclo[3.2.1]octane
The XLogP value of 3.1841 indicates that 6-({2-Nitrophenyl}sulfonyl)-1,3,3-trimethyl-6-azabicyclo[3.2.1]octane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.52 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-({2-Nitrophenyl}sulfonyl)-1,3,3-trimethyl-6-azabicyclo[3.2.1]octane. Following Lipinski's Rule of Five, 6-({2-Nitrophenyl}sulfonyl)-1,3,3-trimethyl-6-azabicyclo[3.2.1]octane has 0 hydrogen bond donor(s) and 4 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 6-({2-Nitrophenyl}sulfonyl)-1,3,3-trimethyl-6-azabicyclo[3.2.1]octane?
The CAS number of 6-({2-Nitrophenyl}sulfonyl)-1,3,3-trimethyl-6-azabicyclo[3.2.1]octane is 305853-88-7.
What is the molecular formula of 6-({2-Nitrophenyl}sulfonyl)-1,3,3-trimethyl-6-azabicyclo[3.2.1]octane?
The molecular formula of 6-({2-Nitrophenyl}sulfonyl)-1,3,3-trimethyl-6-azabicyclo[3.2.1]octane is C16H22N2O4S.
What is the molecular weight of 6-({2-Nitrophenyl}sulfonyl)-1,3,3-trimethyl-6-azabicyclo[3.2.1]octane?
The molecular weight of 6-({2-Nitrophenyl}sulfonyl)-1,3,3-trimethyl-6-azabicyclo[3.2.1]octane is 338.13 g/mol.
Where can I buy 6-({2-Nitrophenyl}sulfonyl)-1,3,3-trimethyl-6-azabicyclo[3.2.1]octane?
You can request a quote for 6-({2-Nitrophenyl}sulfonyl)-1,3,3-trimethyl-6-azabicyclo[3.2.1]octane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-({2-Nitrophenyl}sulfonyl)-1,3,3-trimethyl-6-azabicyclo[3.2.1]octane?
Yes, KEHONG BIO provides custom synthesis services for 6-({2-Nitrophenyl}sulfonyl)-1,3,3-trimethyl-6-azabicyclo[3.2.1]octane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.