![Dimethyl 4-methoxy-2,5-dimethyl-3-azatricyclo[4.2.2.0~2,5~]deca-3,7,9-triene-7,8-dicarboxylate structure](/static/products/2706/27062-44-8.webp)
Dimethyl 4-methoxy-2,5-dimethyl-3-azatricyclo[4.2.2.0~2,5~]deca-3,7,9-triene-7,8-dicarboxylate
TL;DR: Dimethyl 4-methoxy-2,5-dimethyl-3-azatricyclo[4.2.2.0~2,5~]deca-3,7,9-triene-7,8-dicarboxylate (CAS 27062-44-8) is a chemical compound with molecular formula C16H19NO5 and molecular weight 305.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl 4-methoxy-2,5-dimethyl-3-azatricyclo[4.2.2.02,5]deca-3,7,9-triene-7,8-dicarboxylate
Also Known As: Dimethyl 4-methoxy-2,5-dimethyl-3-azatricyclo[4.2.2.0~2,5~]deca-3,7,9-triene-7,8-dicarboxylate, Dimethyl 4-methoxy-2,5-dimethyl-3-azatricyclo[4.2.2.02,5]deca-3,7,9-triene-7,8-dicarboxylate
| Molecular Formula | C16H19NO5 |
|---|---|
| Molecular Weight | 305.13 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 74.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 305.1263 |
| Heavy Atoms | 22 |
| Complexity | 661.0 |
Chemical Identifiers
| CAS Number | 27062-44-8 |
|---|---|
| SMILES | CC12C3C=CC(C1(N=C2OC)C)C(=C3C(=O)OC)C(=O)OC |
| InChIKey | KXEAUQSNZSTHJQ-UHFFFAOYSA-N |
Product Overview
Dimethyl 4-methoxy-2,5-dimethyl-3-azatricyclo[4.2.2.0~2,5~]deca-3,7,9-triene-7,8-dicarboxylate (CAS 27062-44-8), with molecular formula C16H19NO5 and molecular weight 305.13 g/mol. IUPAC: dimethyl 4-methoxy-2,5-dimethyl-3-azatricyclo[4.2.2.02,5]deca-3,7,9-triene-7,8-dicarboxylate.
Chemical Property Profile of Dimethyl 4-methoxy-2,5-dimethyl-3-azatricyclo[4.2.2.0~2,5~]deca-3,7,9-triene-7,8-dicarboxylate
Property Insights of Dimethyl 4-methoxy-2,5-dimethyl-3-azatricyclo[4.2.2.0~2,5~]deca-3,7,9-triene-7,8-dicarboxylate
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dimethyl 4-methoxy-2,5-dimethyl-3-azatricyclo[4.2.2.0~2,5~]deca-3,7,9-triene-7,8-dicarboxylate. The TPSA of 74.2 Ų falls within the moderate polarity range, balancing permeability and solubility for Dimethyl 4-methoxy-2,5-dimethyl-3-azatricyclo[4.2.2.0~2,5~]deca-3,7,9-triene-7,8-dicarboxylate. Following Lipinski's Rule of Five, Dimethyl 4-methoxy-2,5-dimethyl-3-azatricyclo[4.2.2.0~2,5~]deca-3,7,9-triene-7,8-dicarboxylate has 0 hydrogen bond donor(s) and 6 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 Dimethyl 4-methoxy-2,5-dimethyl-3-azatricyclo[4.2.2.0~2,5~]deca-3,7,9-triene-7,8-dicarboxylate?
The CAS number of Dimethyl 4-methoxy-2,5-dimethyl-3-azatricyclo[4.2.2.0~2,5~]deca-3,7,9-triene-7,8-dicarboxylate is 27062-44-8.
What is the molecular formula of Dimethyl 4-methoxy-2,5-dimethyl-3-azatricyclo[4.2.2.0~2,5~]deca-3,7,9-triene-7,8-dicarboxylate?
The molecular formula of Dimethyl 4-methoxy-2,5-dimethyl-3-azatricyclo[4.2.2.0~2,5~]deca-3,7,9-triene-7,8-dicarboxylate is C16H19NO5.
What is the molecular weight of Dimethyl 4-methoxy-2,5-dimethyl-3-azatricyclo[4.2.2.0~2,5~]deca-3,7,9-triene-7,8-dicarboxylate?
The molecular weight of Dimethyl 4-methoxy-2,5-dimethyl-3-azatricyclo[4.2.2.0~2,5~]deca-3,7,9-triene-7,8-dicarboxylate is 305.13 g/mol.
Where can I buy Dimethyl 4-methoxy-2,5-dimethyl-3-azatricyclo[4.2.2.0~2,5~]deca-3,7,9-triene-7,8-dicarboxylate?
You can request a quote for Dimethyl 4-methoxy-2,5-dimethyl-3-azatricyclo[4.2.2.0~2,5~]deca-3,7,9-triene-7,8-dicarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dimethyl 4-methoxy-2,5-dimethyl-3-azatricyclo[4.2.2.0~2,5~]deca-3,7,9-triene-7,8-dicarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Dimethyl 4-methoxy-2,5-dimethyl-3-azatricyclo[4.2.2.0~2,5~]deca-3,7,9-triene-7,8-dicarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.