![diethyl 2-benzyl-1,3-dimethyl-6-oxo-2,6-dihydrocyclohepta[c]pyrrole-5,7-dicarboxylate structure](/static/products/3270/327060-73-1.webp)
diethyl 2-benzyl-1,3-dimethyl-6-oxo-2,6-dihydrocyclohepta[c]pyrrole-5,7-dicarboxylate
TL;DR: diethyl 2-benzyl-1,3-dimethyl-6-oxo-2,6-dihydrocyclohepta[c]pyrrole-5,7-dicarboxylate (CAS 327060-73-1) is a chemical compound with molecular formula C24H25NO5 and molecular weight 407.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl 2-benzyl-1,3-dimethyl-6-oxocyclohepta[c]pyrrole-5,7-dicarboxylate
Also Known As: diethyl 2-benzyl-1,3-dimethyl-6-oxo-2,6-dihydrocyclohepta[c]pyrrole-5,7-dicarboxylate, diethyl 2-benzyl-1,3-dimethyl-6-oxocyclohepta[c]pyrrole-5,7-dicarboxylate, 5,7-DIETHYL 2-BENZYL-1,3-DIMETHYL-6-OXO-2H,6H-CYCLOHEPTA[C]PYRROLE-5,7-DICARBOXYLATE, ethyl 7-(ethoxycarbonyl)-1,3-dimethyl-6-oxo-2-benzylcyclohepta[4,3-c]pyrrole-5 -carboxylate
| Molecular Formula | C24H25NO5 |
|---|---|
| Molecular Weight | 407.17 g/mol |
| LogP | 4.02004 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 407.17328 |
| Heavy Atoms | 30 |
| Complexity | 1094.1653 |
Chemical Identifiers
| CAS Number | 327060-73-1 |
|---|---|
| SMILES | CCOC(=O)C1=CC2=C(N(C(=C2C=C(C1=O)C(=O)OCC)C)CC3=CC=CC=C3)C |
Product Overview
diethyl 2-benzyl-1,3-dimethyl-6-oxo-2,6-dihydrocyclohepta[c]pyrrole-5,7-dicarboxylate (CAS 327060-73-1), with molecular formula C24H25NO5 and molecular weight 407.17 g/mol. IUPAC: diethyl 2-benzyl-1,3-dimethyl-6-oxocyclohepta[c]pyrrole-5,7-dicarboxylate.
Chemical Property Profile of diethyl 2-benzyl-1,3-dimethyl-6-oxo-2,6-dihydrocyclohepta[c]pyrrole-5,7-dicarboxylate
Property Insights of diethyl 2-benzyl-1,3-dimethyl-6-oxo-2,6-dihydrocyclohepta[c]pyrrole-5,7-dicarboxylate
The XLogP value of 4.02004 indicates that diethyl 2-benzyl-1,3-dimethyl-6-oxo-2,6-dihydrocyclohepta[c]pyrrole-5,7-dicarboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for diethyl 2-benzyl-1,3-dimethyl-6-oxo-2,6-dihydrocyclohepta[c]pyrrole-5,7-dicarboxylate. Following Lipinski's Rule of Five, diethyl 2-benzyl-1,3-dimethyl-6-oxo-2,6-dihydrocyclohepta[c]pyrrole-5,7-dicarboxylate 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 diethyl 2-benzyl-1,3-dimethyl-6-oxo-2,6-dihydrocyclohepta[c]pyrrole-5,7-dicarboxylate?
The CAS number of diethyl 2-benzyl-1,3-dimethyl-6-oxo-2,6-dihydrocyclohepta[c]pyrrole-5,7-dicarboxylate is 327060-73-1.
What is the molecular formula of diethyl 2-benzyl-1,3-dimethyl-6-oxo-2,6-dihydrocyclohepta[c]pyrrole-5,7-dicarboxylate?
The molecular formula of diethyl 2-benzyl-1,3-dimethyl-6-oxo-2,6-dihydrocyclohepta[c]pyrrole-5,7-dicarboxylate is C24H25NO5.
What is the molecular weight of diethyl 2-benzyl-1,3-dimethyl-6-oxo-2,6-dihydrocyclohepta[c]pyrrole-5,7-dicarboxylate?
The molecular weight of diethyl 2-benzyl-1,3-dimethyl-6-oxo-2,6-dihydrocyclohepta[c]pyrrole-5,7-dicarboxylate is 407.17 g/mol.
Where can I buy diethyl 2-benzyl-1,3-dimethyl-6-oxo-2,6-dihydrocyclohepta[c]pyrrole-5,7-dicarboxylate?
You can request a quote for diethyl 2-benzyl-1,3-dimethyl-6-oxo-2,6-dihydrocyclohepta[c]pyrrole-5,7-dicarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for diethyl 2-benzyl-1,3-dimethyl-6-oxo-2,6-dihydrocyclohepta[c]pyrrole-5,7-dicarboxylate?
Yes, KEHONG BIO provides custom synthesis services for diethyl 2-benzyl-1,3-dimethyl-6-oxo-2,6-dihydrocyclohepta[c]pyrrole-5,7-dicarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.