![Spiro[benzofuran-2(3H),1'-[3]cyclohexene]-2',3-dione, 7-chloro-4',6-dimethoxy-6'-methyl-4-(1-pyrrolidinyl)- structure](/static/products/268/26891-71-4.png)
Spiro[benzofuran-2(3H),1'-[3]cyclohexene]-2',3-dione, 7-chloro-4',6-dimethoxy-6'-methyl-4-(1-pyrrolidinyl)-
TL;DR: Spiro[benzofuran-2(3H),1'-[3]cyclohexene]-2',3-dione, 7-chloro-4',6-dimethoxy-6'-methyl-4-(1-pyrrolidinyl)- (CAS 26891-71-4) is a chemical compound with molecular formula C20H22ClNO5 and molecular weight 391.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-chloro-3',6-dimethoxy-5'-methyl-4-pyrrolidin-1-ylspiro[1-benzofuran-2,6'-cyclohex-2-ene]-1',3-dione
Also Known As: Spiro[benzofuran-2(3H),1'-[3]cyclohexene]-2',3-dione, 7-chloro-4',6-dimethoxy-6'-methyl-4-(1-pyrrolidinyl)-, 7-Chloro-4',6-dimethoxy-6'-methyl-4- spiro[benzofuran-2 ,1'-[3]cyclohexene]-2',3-dione, 7-chloro-3',6-dimethoxy-5'-methyl-4-pyrrolidin-1-ylspiro[1-benzofuran-2,6'-cyclohex-2-ene]-1',3-dione, 7-Chloro-4 ,6-dimethoxy-6 -methyl-4-(1-pyrrolidinyl)spiro[benzofuran-2(3H),1 -[3]cyclohexene]-2 ,3-dione, 7-chloro-4',6-dimethoxy-6'-methyl-4-(pyrrolidin-1-yl)-3H-spiro[1-benzofuran-2,1'-cyclohexan]-3'-ene-2',3-dione
| Molecular Formula | C20H22ClNO5 |
|---|---|
| Molecular Weight | 391.12 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 65.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 391.11865 |
| Heavy Atoms | 27 |
| Complexity | 661.0 |
Chemical Identifiers
| CAS Number | 26891-71-4 |
|---|---|
| SMILES | CC1CC(=CC(=O)C12C(=O)C3=C(O2)C(=C(C=C3N4CCCC4)OC)Cl)OC |
| InChIKey | WUURRUNQKDIFLO-UHFFFAOYSA-N |
Product Overview
Spiro[benzofuran-2(3H),1'-[3]cyclohexene]-2',3-dione, 7-chloro-4',6-dimethoxy-6'-methyl-4-(1-pyrrolidinyl)- (CAS 26891-71-4), with molecular formula C20H22ClNO5 and molecular weight 391.12 g/mol. IUPAC: 7-chloro-3',6-dimethoxy-5'-methyl-4-pyrrolidin-1-ylspiro[1-benzofuran-2,6'-cyclohex-2-ene]-1',3-dione.
Chemical Property Profile of Spiro[benzofuran-2(3H),1'-[3]cyclohexene]-2',3-dione, 7-chloro-4',6-dimethoxy-6'-methyl-4-(1-pyrrolidinyl)-
Property Insights of Spiro[benzofuran-2(3H),1'-[3]cyclohexene]-2',3-dione, 7-chloro-4',6-dimethoxy-6'-methyl-4-(1-pyrrolidinyl)-
The XLogP value of 3.6 indicates that Spiro[benzofuran-2(3H),1'-[3]cyclohexene]-2',3-dione, 7-chloro-4',6-dimethoxy-6'-methyl-4-(1-pyrrolidinyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Spiro[benzofuran-2(3H),1'-[3]cyclohexene]-2',3-dione, 7-chloro-4',6-dimethoxy-6'-methyl-4-(1-pyrrolidinyl)-. Following Lipinski's Rule of Five, Spiro[benzofuran-2(3H),1'-[3]cyclohexene]-2',3-dione, 7-chloro-4',6-dimethoxy-6'-methyl-4-(1-pyrrolidinyl)- 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 Spiro[benzofuran-2(3H),1'-[3]cyclohexene]-2',3-dione, 7-chloro-4',6-dimethoxy-6'-methyl-4-(1-pyrrolidinyl)-?
The CAS number of Spiro[benzofuran-2(3H),1'-[3]cyclohexene]-2',3-dione, 7-chloro-4',6-dimethoxy-6'-methyl-4-(1-pyrrolidinyl)- is 26891-71-4.
What is the molecular formula of Spiro[benzofuran-2(3H),1'-[3]cyclohexene]-2',3-dione, 7-chloro-4',6-dimethoxy-6'-methyl-4-(1-pyrrolidinyl)-?
The molecular formula of Spiro[benzofuran-2(3H),1'-[3]cyclohexene]-2',3-dione, 7-chloro-4',6-dimethoxy-6'-methyl-4-(1-pyrrolidinyl)- is C20H22ClNO5.
What is the molecular weight of Spiro[benzofuran-2(3H),1'-[3]cyclohexene]-2',3-dione, 7-chloro-4',6-dimethoxy-6'-methyl-4-(1-pyrrolidinyl)-?
The molecular weight of Spiro[benzofuran-2(3H),1'-[3]cyclohexene]-2',3-dione, 7-chloro-4',6-dimethoxy-6'-methyl-4-(1-pyrrolidinyl)- is 391.12 g/mol.
Where can I buy Spiro[benzofuran-2(3H),1'-[3]cyclohexene]-2',3-dione, 7-chloro-4',6-dimethoxy-6'-methyl-4-(1-pyrrolidinyl)-?
You can request a quote for Spiro[benzofuran-2(3H),1'-[3]cyclohexene]-2',3-dione, 7-chloro-4',6-dimethoxy-6'-methyl-4-(1-pyrrolidinyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Spiro[benzofuran-2(3H),1'-[3]cyclohexene]-2',3-dione, 7-chloro-4',6-dimethoxy-6'-methyl-4-(1-pyrrolidinyl)-?
Yes, KEHONG BIO provides custom synthesis services for Spiro[benzofuran-2(3H),1'-[3]cyclohexene]-2',3-dione, 7-chloro-4',6-dimethoxy-6'-methyl-4-(1-pyrrolidinyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.