(1R,5S)-1,3,5-trimethyl-3,7-diazabicyclo[3.3.1]nonane
TL;DR: (1R,5S)-1,3,5-trimethyl-3,7-diazabicyclo[3.3.1]nonane (CAS 169177-35-9) is a chemical compound with molecular formula C10H20N2 and molecular weight 168.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1S,5R)-1,3,5-trimethyl-3,7-diazabicyclo[3.3.1]nonane
Also Known As: 5449AD, 1,3,5-trimethyl-3,7-diazabicyclo[3.3.1]nonane, BAS 00334627, 1,3,5-Trimethyl-3,7-diaza-bicyclo[3.3.1]nonane, (1R,5S)-1,3,5-trimethyl-3,7-diazabicyclo[3.3.1]nonane
| Molecular Formula | C10H20N2 |
|---|---|
| Molecular Weight | 168.16 g/mol |
| LogP | 0.9377 |
| Topological Polar Surface Area | 15.27 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 168.16264 |
| Heavy Atoms | 12 |
| Complexity | 174.2776 |
Chemical Identifiers
| CAS Number | 169177-35-9 |
|---|---|
| SMILES | C[C@@]12C[C@@](CNC1)(CN(C2)C)C |
Product Overview
(1R,5S)-1,3,5-trimethyl-3,7-diazabicyclo[3.3.1]nonane (CAS 169177-35-9), with molecular formula C10H20N2 and molecular weight 168.16 g/mol. IUPAC: (1S,5R)-1,3,5-trimethyl-3,7-diazabicyclo[3.3.1]nonane.
Chemical Property Profile of (1R,5S)-1,3,5-trimethyl-3,7-diazabicyclo[3.3.1]nonane
Property Insights of (1R,5S)-1,3,5-trimethyl-3,7-diazabicyclo[3.3.1]nonane
The XLogP value of 0.9377 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (1R,5S)-1,3,5-trimethyl-3,7-diazabicyclo[3.3.1]nonane. With a topological polar surface area (TPSA) of 15.27 Ų, (1R,5S)-1,3,5-trimethyl-3,7-diazabicyclo[3.3.1]nonane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (1R,5S)-1,3,5-trimethyl-3,7-diazabicyclo[3.3.1]nonane has 1 hydrogen bond donor(s) and 2 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 (1R,5S)-1,3,5-trimethyl-3,7-diazabicyclo[3.3.1]nonane?
The CAS number of (1R,5S)-1,3,5-trimethyl-3,7-diazabicyclo[3.3.1]nonane is 169177-35-9.
What is the molecular formula of (1R,5S)-1,3,5-trimethyl-3,7-diazabicyclo[3.3.1]nonane?
The molecular formula of (1R,5S)-1,3,5-trimethyl-3,7-diazabicyclo[3.3.1]nonane is C10H20N2.
What is the molecular weight of (1R,5S)-1,3,5-trimethyl-3,7-diazabicyclo[3.3.1]nonane?
The molecular weight of (1R,5S)-1,3,5-trimethyl-3,7-diazabicyclo[3.3.1]nonane is 168.16 g/mol.
Where can I buy (1R,5S)-1,3,5-trimethyl-3,7-diazabicyclo[3.3.1]nonane?
You can request a quote for (1R,5S)-1,3,5-trimethyl-3,7-diazabicyclo[3.3.1]nonane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (1R,5S)-1,3,5-trimethyl-3,7-diazabicyclo[3.3.1]nonane?
Yes, KEHONG BIO provides custom synthesis services for (1R,5S)-1,3,5-trimethyl-3,7-diazabicyclo[3.3.1]nonane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.