![(1rN,2cH,4cH,5cN)-3-oxa-6,7-diaza-tricyclo[3.2.2.02,4]non-8- structure](/static/products/5228/5228-86-4.webp)
(1rN,2cH,4cH,5cN)-3-oxa-6,7-diaza-tricyclo[3.2.2.02,4]non-8-
TL;DR: (1rN,2cH,4cH,5cN)-3-oxa-6,7-diaza-tricyclo[3.2.2.02,4]non-8- (CAS 5228-86-4) is a chemical compound with molecular formula C12H10Cl6N2O5 and molecular weight 471.87 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis(2,2,2-trichloroethyl) 3-oxa-6,7-diazatricyclo[3.2.2.02,4]non-8-ene-6,7-dicarboxylate
Also Known As: (1rN,2cH,4cH,5cN)-3-oxa-6,7-diaza-tricyclo[3.2.2.02,4]non-8-, Bis(2,2,2-trichloroethyl) 3-oxa-6,7-diazatricyclo[3.2.2.0~2,4~]non-8-ene-6,7-dicarboxylate, Bis(2,2,2-trichloroethyl) 3-oxa-6,7-diazatricyclo[3.2.2.02,4]non-8-ene-6,7-dicarboxylate
| Molecular Formula | C12H10Cl6N2O5 |
|---|---|
| Molecular Weight | 471.87 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 71.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 471.8721 |
| Heavy Atoms | 25 |
| Complexity | 556.0 |
Chemical Identifiers
| CAS Number | 5228-86-4 |
|---|---|
| SMILES | C1=CC2C3C(C1N(N2C(=O)OCC(Cl)(Cl)Cl)C(=O)OCC(Cl)(Cl)Cl)O3 |
| InChIKey | RYAVNJPNDGDUFL-UHFFFAOYSA-N |
Product Overview
(1rN,2cH,4cH,5cN)-3-oxa-6,7-diaza-tricyclo[3.2.2.02,4]non-8- (CAS 5228-86-4), with molecular formula C12H10Cl6N2O5 and molecular weight 471.87 g/mol. IUPAC: bis(2,2,2-trichloroethyl) 3-oxa-6,7-diazatricyclo[3.2.2.02,4]non-8-ene-6,7-dicarboxylate.
Chemical Property Profile of (1rN,2cH,4cH,5cN)-3-oxa-6,7-diaza-tricyclo[3.2.2.02,4]non-8-
Property Insights of (1rN,2cH,4cH,5cN)-3-oxa-6,7-diaza-tricyclo[3.2.2.02,4]non-8-
The XLogP value of 3.8 indicates that (1rN,2cH,4cH,5cN)-3-oxa-6,7-diaza-tricyclo[3.2.2.02,4]non-8- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.6 Ų falls within the moderate polarity range, balancing permeability and solubility for (1rN,2cH,4cH,5cN)-3-oxa-6,7-diaza-tricyclo[3.2.2.02,4]non-8-. Following Lipinski's Rule of Five, (1rN,2cH,4cH,5cN)-3-oxa-6,7-diaza-tricyclo[3.2.2.02,4]non-8- 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
Frequently Asked Questions
What is the CAS number of (1rN,2cH,4cH,5cN)-3-oxa-6,7-diaza-tricyclo[3.2.2.02,4]non-8-?
The CAS number of (1rN,2cH,4cH,5cN)-3-oxa-6,7-diaza-tricyclo[3.2.2.02,4]non-8- is 5228-86-4.
What is the molecular formula of (1rN,2cH,4cH,5cN)-3-oxa-6,7-diaza-tricyclo[3.2.2.02,4]non-8-?
The molecular formula of (1rN,2cH,4cH,5cN)-3-oxa-6,7-diaza-tricyclo[3.2.2.02,4]non-8- is C12H10Cl6N2O5.
What is the molecular weight of (1rN,2cH,4cH,5cN)-3-oxa-6,7-diaza-tricyclo[3.2.2.02,4]non-8-?
The molecular weight of (1rN,2cH,4cH,5cN)-3-oxa-6,7-diaza-tricyclo[3.2.2.02,4]non-8- is 471.87 g/mol.
Where can I buy (1rN,2cH,4cH,5cN)-3-oxa-6,7-diaza-tricyclo[3.2.2.02,4]non-8-?
You can request a quote for (1rN,2cH,4cH,5cN)-3-oxa-6,7-diaza-tricyclo[3.2.2.02,4]non-8- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (1rN,2cH,4cH,5cN)-3-oxa-6,7-diaza-tricyclo[3.2.2.02,4]non-8-?
Yes, KEHONG BIO provides custom synthesis services for (1rN,2cH,4cH,5cN)-3-oxa-6,7-diaza-tricyclo[3.2.2.02,4]non-8- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.