9,9-Dimethyl-3-(1-methylethyl)-7-(2-thienylsulfonyl)-3,7-diazabicyclo(3.3.1)nonane
TL;DR: 9,9-Dimethyl-3-(1-methylethyl)-7-(2-thienylsulfonyl)-3,7-diazabicyclo(3.3.1)nonane (CAS 120466-02-6) is a chemical compound with molecular formula C16H26N2O2S2 and molecular weight 342.1436 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
9,9-dimethyl-3-propan-2-yl-7-thiophen-2-ylsulfonyl-3,7-diazabicyclo[3.3.1]nonane
Also Known As: 9,9-Dimethyl-3-(1-methylethyl)-7-(2-thienylsulfonyl)-3,7-diazabicyclo(3.3.1)nonane, 3,7-Diazabicyclo(3.3.1)nonane, 9,9-dimethyl-3-(1-methylethyl)-7-(2-thienylsulfonyl)-, 9,9-Dimethyl-3-(propan-2-yl)-7-(thiophene-2-sulfonyl)-3,7-diazabicyclo[3.3.1]nonane, 9,9-dimethyl-7-propan-2-yl-3-thiophen-2-ylsulfonyl-3,7-diazabicyclo[3.3.1]nonane
Technical Specifications
| Molecular Formula | C16H26N2O2S2 |
| Molecular Weight | 342.1436 g/mol |
| XLogP | 3.2 |
| Topological Polar Surface Area (TPSA) | 77.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 342.1436 Da |
| Heavy Atoms | 22 |
| Complexity | 495.0 |
| SMILES | CC(C)N1CC2CN(CC(C1)C2(C)C)S(=O)(=O)C3=CC=CS3 |
| InChIKey | BUWBZGORDKJBLO-UHFFFAOYSA-N |
Chemical Property Profile of 9,9-Dimethyl-3-(1-methylethyl)-7-(2-thienylsulfonyl)-3,7-diazabicyclo(3.3.1)nonane
Property Insights of 9,9-Dimethyl-3-(1-methylethyl)-7-(2-thienylsulfonyl)-3,7-diazabicyclo(3.3.1)nonane
The XLogP value of 3.2 indicates that 9,9-Dimethyl-3-(1-methylethyl)-7-(2-thienylsulfonyl)-3,7-diazabicyclo(3.3.1)nonane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 9,9-Dimethyl-3-(1-methylethyl)-7-(2-thienylsulfonyl)-3,7-diazabicyclo(3.3.1)nonane. Following Lipinski's Rule of Five, 9,9-Dimethyl-3-(1-methylethyl)-7-(2-thienylsulfonyl)-3,7-diazabicyclo(3.3.1)nonane has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 9,9-Dimethyl-3-(1-methylethyl)-7-(2-thienylsulfonyl)-3,7-diazabicyclo(3.3.1)nonane?
The CAS number of 9,9-Dimethyl-3-(1-methylethyl)-7-(2-thienylsulfonyl)-3,7-diazabicyclo(3.3.1)nonane is 120466-02-6.
What is the molecular formula of 9,9-Dimethyl-3-(1-methylethyl)-7-(2-thienylsulfonyl)-3,7-diazabicyclo(3.3.1)nonane?
The molecular formula of 9,9-Dimethyl-3-(1-methylethyl)-7-(2-thienylsulfonyl)-3,7-diazabicyclo(3.3.1)nonane is C16H26N2O2S2.
What is the molecular weight of 9,9-Dimethyl-3-(1-methylethyl)-7-(2-thienylsulfonyl)-3,7-diazabicyclo(3.3.1)nonane?
The molecular weight of 9,9-Dimethyl-3-(1-methylethyl)-7-(2-thienylsulfonyl)-3,7-diazabicyclo(3.3.1)nonane is 342.1436 g/mol.
Where can I buy 9,9-Dimethyl-3-(1-methylethyl)-7-(2-thienylsulfonyl)-3,7-diazabicyclo(3.3.1)nonane?
You can request a quote for 9,9-Dimethyl-3-(1-methylethyl)-7-(2-thienylsulfonyl)-3,7-diazabicyclo(3.3.1)nonane directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 9,9-Dimethyl-3-(1-methylethyl)-7-(2-thienylsulfonyl)-3,7-diazabicyclo(3.3.1)nonane?
Yes, CoreyChem provides custom synthesis services for 9,9-Dimethyl-3-(1-methylethyl)-7-(2-thienylsulfonyl)-3,7-diazabicyclo(3.3.1)nonane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.