1'-Butyl-5-chlorospiro(benzo(c)thiophene-1(3H),2'-pyrrolidin)-3-one hydrobromide
TL;DR: 1'-Butyl-5-chlorospiro(benzo(c)thiophene-1(3H),2'-pyrrolidin)-3-one hydrobromide (CAS 83962-50-9) is a chemical compound with molecular formula C15H19BrClNOS and molecular weight 375.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1'-butyl-6-chlorospiro[2-benzofuran-3,2'-pyrrolidine]-1-thione;hydrobromide
Also Known As: 1'-Butyl-5-chlorospiro(benzo(c)thiophene-1(3H),2'-pyrrolidin)-3-one hydrobromide, Spiro(benzo(c)thiophene-1(3H),2'-pyrrolidin)-3-one, 1'-butyl-5-chloro-, hydrobromide, 1'-butyl-6-chlorospiro[2-benzofuran-3,2'-pyrrolidine]-1-thione hydrobromide, 1'-Butyl-5-chloro-3H-spiro[[2]benzofuran-1,2'-pyrrolidine]-3-thione--hydrogen bromide (1/1), 1'-Butyl-5-chloro-3H-spiro[2-benzofuran-1,2'-pyrrolidine]-3-thione--hydrogen bromide (1/1)
| Molecular Formula | C15H19BrClNOS |
|---|---|
| Molecular Weight | 375.01 g/mol |
| LogP | 4.6723 |
| Topological Polar Surface Area | 12.47 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 375.00592 |
| Heavy Atoms | 20 |
| Complexity | 524.59503 |
Chemical Identifiers
| CAS Number | 83962-50-9 |
|---|---|
| SMILES | CCCCN1CCCC12C3=C(C=C(C=C3)Cl)C(=S)O2.Br |
Product Overview
1'-Butyl-5-chlorospiro(benzo(c)thiophene-1(3H),2'-pyrrolidin)-3-one hydrobromide (CAS 83962-50-9), with molecular formula C15H19BrClNOS and molecular weight 375.01 g/mol. IUPAC: 1'-butyl-6-chlorospiro[2-benzofuran-3,2'-pyrrolidine]-1-thione;hydrobromide.
Chemical Property Profile of 1'-Butyl-5-chlorospiro(benzo(c)thiophene-1(3H),2'-pyrrolidin)-3-one hydrobromide
Property Insights of 1'-Butyl-5-chlorospiro(benzo(c)thiophene-1(3H),2'-pyrrolidin)-3-one hydrobromide
The XLogP value of 4.6723 indicates that 1'-Butyl-5-chlorospiro(benzo(c)thiophene-1(3H),2'-pyrrolidin)-3-one hydrobromide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.47 Ų, 1'-Butyl-5-chlorospiro(benzo(c)thiophene-1(3H),2'-pyrrolidin)-3-one hydrobromide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1'-Butyl-5-chlorospiro(benzo(c)thiophene-1(3H),2'-pyrrolidin)-3-one hydrobromide has 0 hydrogen bond donor(s) and 3 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'-Butyl-5-chlorospiro(benzo(c)thiophene-1(3H),2'-pyrrolidin)-3-one hydrobromide?
The CAS number of 1'-Butyl-5-chlorospiro(benzo(c)thiophene-1(3H),2'-pyrrolidin)-3-one hydrobromide is 83962-50-9.
What is the molecular formula of 1'-Butyl-5-chlorospiro(benzo(c)thiophene-1(3H),2'-pyrrolidin)-3-one hydrobromide?
The molecular formula of 1'-Butyl-5-chlorospiro(benzo(c)thiophene-1(3H),2'-pyrrolidin)-3-one hydrobromide is C15H19BrClNOS.
What is the molecular weight of 1'-Butyl-5-chlorospiro(benzo(c)thiophene-1(3H),2'-pyrrolidin)-3-one hydrobromide?
The molecular weight of 1'-Butyl-5-chlorospiro(benzo(c)thiophene-1(3H),2'-pyrrolidin)-3-one hydrobromide is 375.01 g/mol.
Where can I buy 1'-Butyl-5-chlorospiro(benzo(c)thiophene-1(3H),2'-pyrrolidin)-3-one hydrobromide?
You can request a quote for 1'-Butyl-5-chlorospiro(benzo(c)thiophene-1(3H),2'-pyrrolidin)-3-one hydrobromide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1'-Butyl-5-chlorospiro(benzo(c)thiophene-1(3H),2'-pyrrolidin)-3-one hydrobromide?
Yes, KEHONG BIO provides custom synthesis services for 1'-Butyl-5-chlorospiro(benzo(c)thiophene-1(3H),2'-pyrrolidin)-3-one hydrobromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.