![7-Chloro-1,7-diazabicyclo[2.2.1]heptane structure](/static/products/796/79614-45-2.png)
7-Chloro-1,7-diazabicyclo[2.2.1]heptane
TL;DR: 7-Chloro-1,7-diazabicyclo[2.2.1]heptane (CAS 79614-45-2) is a chemical compound with molecular formula C5H9ClN2 and molecular weight 132.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-chloro-1,7-diazabicyclo[2.2.1]heptane
Also Known As: 7-Chloro-1,7-diazabicyclo[2.2.1]heptane, 7-Chloro-1,7-diaza-bicyclo[2.2.1]heptane, 1,7-Diazabicyclo[2.2.0]heptane, 7-chloro-, 1,7-Diazabicyclo[2.2.1]heptane, 7-chloro-, 7-Chloro-1,7-diazabicyclo[2.2.1]heptane #
| Molecular Formula | C5H9ClN2 |
|---|---|
| Molecular Weight | 132.05 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 6.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 132.04543 |
| Heavy Atoms | 8 |
| Complexity | 98.0 |
Chemical Identifiers
| CAS Number | 79614-45-2 |
|---|---|
| SMILES | C1CN2CCC1N2Cl |
| InChIKey | KZQDLEGKLZWKNE-UHFFFAOYSA-N |
Product Overview
7-Chloro-1,7-diazabicyclo[2.2.1]heptane (CAS 79614-45-2), with molecular formula C5H9ClN2 and molecular weight 132.05 g/mol. IUPAC: 7-chloro-1,7-diazabicyclo[2.2.1]heptane.
Chemical Property Profile of 7-Chloro-1,7-diazabicyclo[2.2.1]heptane
Property Insights of 7-Chloro-1,7-diazabicyclo[2.2.1]heptane
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 7-Chloro-1,7-diazabicyclo[2.2.1]heptane. With a topological polar surface area (TPSA) of 6.5 Ų, 7-Chloro-1,7-diazabicyclo[2.2.1]heptane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7-Chloro-1,7-diazabicyclo[2.2.1]heptane has 0 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 7-Chloro-1,7-diazabicyclo[2.2.1]heptane?
The CAS number of 7-Chloro-1,7-diazabicyclo[2.2.1]heptane is 79614-45-2.
What is the molecular formula of 7-Chloro-1,7-diazabicyclo[2.2.1]heptane?
The molecular formula of 7-Chloro-1,7-diazabicyclo[2.2.1]heptane is C5H9ClN2.
What is the molecular weight of 7-Chloro-1,7-diazabicyclo[2.2.1]heptane?
The molecular weight of 7-Chloro-1,7-diazabicyclo[2.2.1]heptane is 132.05 g/mol.
Where can I buy 7-Chloro-1,7-diazabicyclo[2.2.1]heptane?
You can request a quote for 7-Chloro-1,7-diazabicyclo[2.2.1]heptane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-Chloro-1,7-diazabicyclo[2.2.1]heptane?
Yes, KEHONG BIO provides custom synthesis services for 7-Chloro-1,7-diazabicyclo[2.2.1]heptane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.