![3-[4-(1,3-benzothiazol-2-yl)piperazin-1-yl]-1-(3-fluorophenyl)pyrrolidine-2,5-dione structure](/static/products/7256/725699-60-5.webp)
3-[4-(1,3-benzothiazol-2-yl)piperazin-1-yl]-1-(3-fluorophenyl)pyrrolidine-2,5-dione
TL;DR: 3-[4-(1,3-benzothiazol-2-yl)piperazin-1-yl]-1-(3-fluorophenyl)pyrrolidine-2,5-dione (CAS 725699-60-5) is a chemical compound with molecular formula C21H19FN4O2S and molecular weight 410.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[4-(1,3-benzothiazol-2-yl)piperazin-1-yl]-1-(3-fluorophenyl)pyrrolidine-2,5-dione
Also Known As: 3-[4-(1,3-benzothiazol-2-yl)piperazin-1-yl]-1-(3-fluorophenyl)pyrrolidine-2,5-dione, A3717/0157455, 3-[4-(1,3-benzothiazol-2-yl)-1-piperazinyl]-1-(3-fluorophenyl)-2,5-pyrrolidinedione, 3-[4-(1,3-BENZOTHIAZOL-2-YL)PIPERAZINO]-1-(3-FLUOROPHENYL)DIHYDRO-1H-PYRROLE-2,5-DIONE
| Molecular Formula | C21H19FN4O2S |
|---|---|
| Molecular Weight | 410.12 g/mol |
| LogP | 2.8895 |
| Topological Polar Surface Area | 56.75 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 410.12128 |
| Heavy Atoms | 29 |
| Complexity | 1059.9845 |
Chemical Identifiers
| CAS Number | 725699-60-5 |
|---|---|
| SMILES | C1CN(CCN1C2CC(=O)N(C2=O)C3=CC(=CC=C3)F)C4=NC5=CC=CC=C5S4 |
Product Overview
3-[4-(1,3-benzothiazol-2-yl)piperazin-1-yl]-1-(3-fluorophenyl)pyrrolidine-2,5-dione (CAS 725699-60-5), with molecular formula C21H19FN4O2S and molecular weight 410.12 g/mol. IUPAC: 3-[4-(1,3-benzothiazol-2-yl)piperazin-1-yl]-1-(3-fluorophenyl)pyrrolidine-2,5-dione.
Chemical Property Profile of 3-[4-(1,3-benzothiazol-2-yl)piperazin-1-yl]-1-(3-fluorophenyl)pyrrolidine-2,5-dione
Property Insights of 3-[4-(1,3-benzothiazol-2-yl)piperazin-1-yl]-1-(3-fluorophenyl)pyrrolidine-2,5-dione
The XLogP value of 2.8895 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[4-(1,3-benzothiazol-2-yl)piperazin-1-yl]-1-(3-fluorophenyl)pyrrolidine-2,5-dione. With a topological polar surface area (TPSA) of 56.75 Ų, 3-[4-(1,3-benzothiazol-2-yl)piperazin-1-yl]-1-(3-fluorophenyl)pyrrolidine-2,5-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-[4-(1,3-benzothiazol-2-yl)piperazin-1-yl]-1-(3-fluorophenyl)pyrrolidine-2,5-dione 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 3-[4-(1,3-benzothiazol-2-yl)piperazin-1-yl]-1-(3-fluorophenyl)pyrrolidine-2,5-dione?
The CAS number of 3-[4-(1,3-benzothiazol-2-yl)piperazin-1-yl]-1-(3-fluorophenyl)pyrrolidine-2,5-dione is 725699-60-5.
What is the molecular formula of 3-[4-(1,3-benzothiazol-2-yl)piperazin-1-yl]-1-(3-fluorophenyl)pyrrolidine-2,5-dione?
The molecular formula of 3-[4-(1,3-benzothiazol-2-yl)piperazin-1-yl]-1-(3-fluorophenyl)pyrrolidine-2,5-dione is C21H19FN4O2S.
What is the molecular weight of 3-[4-(1,3-benzothiazol-2-yl)piperazin-1-yl]-1-(3-fluorophenyl)pyrrolidine-2,5-dione?
The molecular weight of 3-[4-(1,3-benzothiazol-2-yl)piperazin-1-yl]-1-(3-fluorophenyl)pyrrolidine-2,5-dione is 410.12 g/mol.
Where can I buy 3-[4-(1,3-benzothiazol-2-yl)piperazin-1-yl]-1-(3-fluorophenyl)pyrrolidine-2,5-dione?
You can request a quote for 3-[4-(1,3-benzothiazol-2-yl)piperazin-1-yl]-1-(3-fluorophenyl)pyrrolidine-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-[4-(1,3-benzothiazol-2-yl)piperazin-1-yl]-1-(3-fluorophenyl)pyrrolidine-2,5-dione?
Yes, KEHONG BIO provides custom synthesis services for 3-[4-(1,3-benzothiazol-2-yl)piperazin-1-yl]-1-(3-fluorophenyl)pyrrolidine-2,5-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.