3-(1,3-Benzothiazol-2-ylsulfanyl)-1-benzylpyrrolidine-2,5-dione
TL;DR: 3-(1,3-Benzothiazol-2-ylsulfanyl)-1-benzylpyrrolidine-2,5-dione (CAS 522652-25-1) is a chemical compound with molecular formula C18H14N2O2S2 and molecular weight 354.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(1,3-benzothiazol-2-ylsulfanyl)-1-benzylpyrrolidine-2,5-dione
Also Known As: BAS 05590287, 3-(1,3-benzothiazol-2-ylsulfanyl)-1-benzylpyrrolidine-2,5-dione, 3-benzothiazol-2-ylthio-1-benzylazolidine-2,5-dione, 3-(benzo[d]thiazol-2-ylthio)-1-benzylpyrrolidine-2,5-dione, 3-(Benzothiazol-2-ylsulfanyl)-1-benzyl-pyrrolidine-2,5-dione
| Molecular Formula | C18H14N2O2S2 |
|---|---|
| Molecular Weight | 354.05 g/mol |
| LogP | 3.7161 |
| Topological Polar Surface Area | 50.27 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 354.04968 |
| Heavy Atoms | 24 |
| Complexity | 874.5375 |
Chemical Identifiers
| CAS Number | 522652-25-1 |
|---|---|
| SMILES | C1C(C(=O)N(C1=O)CC2=CC=CC=C2)SC3=NC4=CC=CC=C4S3 |
Product Overview
3-(1,3-Benzothiazol-2-ylsulfanyl)-1-benzylpyrrolidine-2,5-dione (CAS 522652-25-1), with molecular formula C18H14N2O2S2 and molecular weight 354.05 g/mol. IUPAC: 3-(1,3-benzothiazol-2-ylsulfanyl)-1-benzylpyrrolidine-2,5-dione.
Chemical Property Profile of 3-(1,3-Benzothiazol-2-ylsulfanyl)-1-benzylpyrrolidine-2,5-dione
Property Insights of 3-(1,3-Benzothiazol-2-ylsulfanyl)-1-benzylpyrrolidine-2,5-dione
The XLogP value of 3.7161 indicates that 3-(1,3-Benzothiazol-2-ylsulfanyl)-1-benzylpyrrolidine-2,5-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.27 Ų, 3-(1,3-Benzothiazol-2-ylsulfanyl)-1-benzylpyrrolidine-2,5-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(1,3-Benzothiazol-2-ylsulfanyl)-1-benzylpyrrolidine-2,5-dione 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 3-(1,3-Benzothiazol-2-ylsulfanyl)-1-benzylpyrrolidine-2,5-dione?
The CAS number of 3-(1,3-Benzothiazol-2-ylsulfanyl)-1-benzylpyrrolidine-2,5-dione is 522652-25-1.
What is the molecular formula of 3-(1,3-Benzothiazol-2-ylsulfanyl)-1-benzylpyrrolidine-2,5-dione?
The molecular formula of 3-(1,3-Benzothiazol-2-ylsulfanyl)-1-benzylpyrrolidine-2,5-dione is C18H14N2O2S2.
What is the molecular weight of 3-(1,3-Benzothiazol-2-ylsulfanyl)-1-benzylpyrrolidine-2,5-dione?
The molecular weight of 3-(1,3-Benzothiazol-2-ylsulfanyl)-1-benzylpyrrolidine-2,5-dione is 354.05 g/mol.
Where can I buy 3-(1,3-Benzothiazol-2-ylsulfanyl)-1-benzylpyrrolidine-2,5-dione?
You can request a quote for 3-(1,3-Benzothiazol-2-ylsulfanyl)-1-benzylpyrrolidine-2,5-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(1,3-Benzothiazol-2-ylsulfanyl)-1-benzylpyrrolidine-2,5-dione?
Yes, KEHONG BIO provides custom synthesis services for 3-(1,3-Benzothiazol-2-ylsulfanyl)-1-benzylpyrrolidine-2,5-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.