Spiro(benzo(c)thiophene-1(3H),2'-pyrrolidin)-3-one, 6-methoxy-1'-methyl-
TL;DR: Spiro(benzo(c)thiophene-1(3H),2'-pyrrolidin)-3-one, 6-methoxy-1'-methyl- (CAS 83962-39-4) is a chemical compound with molecular formula C13H15NO2S and molecular weight 249.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-methoxy-1'-methylspiro[2-benzofuran-3,2'-pyrrolidine]-1-thione
Also Known As: 6-Methoxy-1'-methylspiro(benzo(c)thiophene-1(3H),2'-pyrrolidin)-3-one, Spiro(benzo(c)thiophene-1(3H),2'-pyrrolidin)-3-one, 6-methoxy-1'-methyl-, 5-methoxy-1'-methylspiro[2-benzofuran-3,2'-pyrrolidine]-1-thione, 6-Methoxy-1'-methyl-3H-spiro[[2]benzofuran-1,2'-pyrrolidine]-3-thione, 6-Methoxy-1'-methyl-3H-spiro[2-benzofuran-1,2'-pyrrolidine]-3-thione
| Molecular Formula | C13H15NO2S |
|---|---|
| Molecular Weight | 249.08 g/mol |
| LogP | 2.2793 |
| Topological Polar Surface Area | 21.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 249.08235 |
| Heavy Atoms | 17 |
| Complexity | 488.30786 |
Chemical Identifiers
| CAS Number | 83962-39-4 |
|---|---|
| SMILES | CN1CCCC12C3=C(C=CC(=C3)OC)C(=S)O2 |
Product Overview
Spiro(benzo(c)thiophene-1(3H),2'-pyrrolidin)-3-one, 6-methoxy-1'-methyl- (CAS 83962-39-4), with molecular formula C13H15NO2S and molecular weight 249.08 g/mol. IUPAC: 5-methoxy-1'-methylspiro[2-benzofuran-3,2'-pyrrolidine]-1-thione.
Chemical Property Profile of Spiro(benzo(c)thiophene-1(3H),2'-pyrrolidin)-3-one, 6-methoxy-1'-methyl-
Property Insights of Spiro(benzo(c)thiophene-1(3H),2'-pyrrolidin)-3-one, 6-methoxy-1'-methyl-
The XLogP value of 2.2793 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Spiro(benzo(c)thiophene-1(3H),2'-pyrrolidin)-3-one, 6-methoxy-1'-methyl-. With a topological polar surface area (TPSA) of 21.7 Ų, Spiro(benzo(c)thiophene-1(3H),2'-pyrrolidin)-3-one, 6-methoxy-1'-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Spiro(benzo(c)thiophene-1(3H),2'-pyrrolidin)-3-one, 6-methoxy-1'-methyl- has 0 hydrogen bond donor(s) and 4 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(benzo(c)thiophene-1(3H),2'-pyrrolidin)-3-one, 6-methoxy-1'-methyl-?
The CAS number of Spiro(benzo(c)thiophene-1(3H),2'-pyrrolidin)-3-one, 6-methoxy-1'-methyl- is 83962-39-4.
What is the molecular formula of Spiro(benzo(c)thiophene-1(3H),2'-pyrrolidin)-3-one, 6-methoxy-1'-methyl-?
The molecular formula of Spiro(benzo(c)thiophene-1(3H),2'-pyrrolidin)-3-one, 6-methoxy-1'-methyl- is C13H15NO2S.
What is the molecular weight of Spiro(benzo(c)thiophene-1(3H),2'-pyrrolidin)-3-one, 6-methoxy-1'-methyl-?
The molecular weight of Spiro(benzo(c)thiophene-1(3H),2'-pyrrolidin)-3-one, 6-methoxy-1'-methyl- is 249.08 g/mol.
Where can I buy Spiro(benzo(c)thiophene-1(3H),2'-pyrrolidin)-3-one, 6-methoxy-1'-methyl-?
You can request a quote for Spiro(benzo(c)thiophene-1(3H),2'-pyrrolidin)-3-one, 6-methoxy-1'-methyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Spiro(benzo(c)thiophene-1(3H),2'-pyrrolidin)-3-one, 6-methoxy-1'-methyl-?
Yes, KEHONG BIO provides custom synthesis services for Spiro(benzo(c)thiophene-1(3H),2'-pyrrolidin)-3-one, 6-methoxy-1'-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.