![1,7-dimethyl-4-(4-nitrophenyl)-10-oxa-4-azatricyclo[5.2.1.0<2,6>]dec-8-ene-3,5 -dione structure](/static/products/4062/406222-19-3.webp)
1,7-dimethyl-4-(4-nitrophenyl)-10-oxa-4-azatricyclo[5.2.1.0<2,6>]dec-8-ene-3,5 -dione
TL;DR: 1,7-dimethyl-4-(4-nitrophenyl)-10-oxa-4-azatricyclo[5.2.1.0<2,6>]dec-8-ene-3,5 -dione (CAS 406222-19-3) is a chemical compound with molecular formula C16H14N2O5 and molecular weight 314.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,7-dimethyl-2-(4-nitrophenyl)-3a,7a-dihydro-4,7-epoxyisoindole-1,3-dione
Also Known As: 1,7-dimethyl-4-(4-nitrophenyl)-10-oxa-4-azatricyclo[5.2.1.0<2,6>]dec-8-ene-3,5 -dione, 4,7-dimethyl-2-(4-nitrophenyl)-3a,4,7,7a-tetrahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione, 4,7-dimethyl-2-(4-nitrophenyl)-3a,7a-dihydro-octahydro-1H-4,7-epoxyisoindole-1,3-dione
| Molecular Formula | C16H14N2O5 |
|---|---|
| Molecular Weight | 314.09 g/mol |
| LogP | 1.8178 |
| Topological Polar Surface Area | 89.75 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 314.09027 |
| Heavy Atoms | 23 |
| Complexity | 750.1653 |
Chemical Identifiers
| CAS Number | 406222-19-3 |
|---|---|
| SMILES | CC12C=CC(O1)(C3C2C(=O)N(C3=O)C4=CC=C(C=C4)[N+](=O)[O-])C |
Product Overview
1,7-dimethyl-4-(4-nitrophenyl)-10-oxa-4-azatricyclo[5.2.1.0<2,6>]dec-8-ene-3,5 -dione (CAS 406222-19-3), with molecular formula C16H14N2O5 and molecular weight 314.09 g/mol. IUPAC: 4,7-dimethyl-2-(4-nitrophenyl)-3a,7a-dihydro-4,7-epoxyisoindole-1,3-dione.
Chemical Property Profile of 1,7-dimethyl-4-(4-nitrophenyl)-10-oxa-4-azatricyclo[5.2.1.0<2,6>]dec-8-ene-3,5 -dione
Property Insights of 1,7-dimethyl-4-(4-nitrophenyl)-10-oxa-4-azatricyclo[5.2.1.0<2,6>]dec-8-ene-3,5 -dione
The XLogP value of 1.8178 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,7-dimethyl-4-(4-nitrophenyl)-10-oxa-4-azatricyclo[5.2.1.0<2,6>]dec-8-ene-3,5 -dione. The TPSA of 89.75 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,7-dimethyl-4-(4-nitrophenyl)-10-oxa-4-azatricyclo[5.2.1.0<2,6>]dec-8-ene-3,5 -dione. Following Lipinski's Rule of Five, 1,7-dimethyl-4-(4-nitrophenyl)-10-oxa-4-azatricyclo[5.2.1.0<2,6>]dec-8-ene-3,5 -dione 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 1,7-dimethyl-4-(4-nitrophenyl)-10-oxa-4-azatricyclo[5.2.1.0<2,6>]dec-8-ene-3,5 -dione?
The CAS number of 1,7-dimethyl-4-(4-nitrophenyl)-10-oxa-4-azatricyclo[5.2.1.0<2,6>]dec-8-ene-3,5 -dione is 406222-19-3.
What is the molecular formula of 1,7-dimethyl-4-(4-nitrophenyl)-10-oxa-4-azatricyclo[5.2.1.0<2,6>]dec-8-ene-3,5 -dione?
The molecular formula of 1,7-dimethyl-4-(4-nitrophenyl)-10-oxa-4-azatricyclo[5.2.1.0<2,6>]dec-8-ene-3,5 -dione is C16H14N2O5.
What is the molecular weight of 1,7-dimethyl-4-(4-nitrophenyl)-10-oxa-4-azatricyclo[5.2.1.0<2,6>]dec-8-ene-3,5 -dione?
The molecular weight of 1,7-dimethyl-4-(4-nitrophenyl)-10-oxa-4-azatricyclo[5.2.1.0<2,6>]dec-8-ene-3,5 -dione is 314.09 g/mol.
Where can I buy 1,7-dimethyl-4-(4-nitrophenyl)-10-oxa-4-azatricyclo[5.2.1.0<2,6>]dec-8-ene-3,5 -dione?
You can request a quote for 1,7-dimethyl-4-(4-nitrophenyl)-10-oxa-4-azatricyclo[5.2.1.0<2,6>]dec-8-ene-3,5 -dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,7-dimethyl-4-(4-nitrophenyl)-10-oxa-4-azatricyclo[5.2.1.0<2,6>]dec-8-ene-3,5 -dione?
Yes, KEHONG BIO provides custom synthesis services for 1,7-dimethyl-4-(4-nitrophenyl)-10-oxa-4-azatricyclo[5.2.1.0<2,6>]dec-8-ene-3,5 -dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.