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[4-(1,1-Dioxo-1,2-benzothiazol-3-yl)piperazin-1-yl]-(4-fluorophenyl)methanone
TL;DR: [4-(1,1-Dioxo-1,2-benzothiazol-3-yl)piperazin-1-yl]-(4-fluorophenyl)methanone (CAS 433322-58-8) is a chemical compound with molecular formula C18H16FN3O3S and molecular weight 373.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-(1,1-dioxo-1,2-benzothiazol-3-yl)piperazin-1-yl]-(4-fluorophenyl)methanone
Also Known As: BAS 03809833, AN-988/40984599, [4-(1,1-dioxo-1,2-benzothiazol-3-yl)piperazin-1-yl]-(4-fluorophenyl)methanone, 3-[4-(4-fluorobenzoyl)-1-piperazinyl]-1,2-benzisothiazole 1,1-dioxide, [4-(1,1-dioxido-1,2-benzothiazol-3-yl)piperazin-1-yl](4-fluorophenyl)methanone
| Molecular Formula | C18H16FN3O3S |
|---|---|
| Molecular Weight | 373.09 g/mol |
| LogP | 1.7326 |
| Topological Polar Surface Area | 70.05 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 373.08963 |
| Heavy Atoms | 26 |
| Complexity | 994.5963 |
Chemical Identifiers
| CAS Number | 433322-58-8 |
|---|---|
| SMILES | C1CN(CCN1C2=NS(=O)(=O)C3=CC=CC=C32)C(=O)C4=CC=C(C=C4)F |
Product Overview
[4-(1,1-Dioxo-1,2-benzothiazol-3-yl)piperazin-1-yl]-(4-fluorophenyl)methanone (CAS 433322-58-8), with molecular formula C18H16FN3O3S and molecular weight 373.09 g/mol. IUPAC: [4-(1,1-dioxo-1,2-benzothiazol-3-yl)piperazin-1-yl]-(4-fluorophenyl)methanone.
Chemical Property Profile of [4-(1,1-Dioxo-1,2-benzothiazol-3-yl)piperazin-1-yl]-(4-fluorophenyl)methanone
Property Insights of [4-(1,1-Dioxo-1,2-benzothiazol-3-yl)piperazin-1-yl]-(4-fluorophenyl)methanone
The XLogP value of 1.7326 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [4-(1,1-Dioxo-1,2-benzothiazol-3-yl)piperazin-1-yl]-(4-fluorophenyl)methanone. The TPSA of 70.05 Ų falls within the moderate polarity range, balancing permeability and solubility for [4-(1,1-Dioxo-1,2-benzothiazol-3-yl)piperazin-1-yl]-(4-fluorophenyl)methanone. Following Lipinski's Rule of Five, [4-(1,1-Dioxo-1,2-benzothiazol-3-yl)piperazin-1-yl]-(4-fluorophenyl)methanone 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 [4-(1,1-Dioxo-1,2-benzothiazol-3-yl)piperazin-1-yl]-(4-fluorophenyl)methanone?
The CAS number of [4-(1,1-Dioxo-1,2-benzothiazol-3-yl)piperazin-1-yl]-(4-fluorophenyl)methanone is 433322-58-8.
What is the molecular formula of [4-(1,1-Dioxo-1,2-benzothiazol-3-yl)piperazin-1-yl]-(4-fluorophenyl)methanone?
The molecular formula of [4-(1,1-Dioxo-1,2-benzothiazol-3-yl)piperazin-1-yl]-(4-fluorophenyl)methanone is C18H16FN3O3S.
What is the molecular weight of [4-(1,1-Dioxo-1,2-benzothiazol-3-yl)piperazin-1-yl]-(4-fluorophenyl)methanone?
The molecular weight of [4-(1,1-Dioxo-1,2-benzothiazol-3-yl)piperazin-1-yl]-(4-fluorophenyl)methanone is 373.09 g/mol.
Where can I buy [4-(1,1-Dioxo-1,2-benzothiazol-3-yl)piperazin-1-yl]-(4-fluorophenyl)methanone?
You can request a quote for [4-(1,1-Dioxo-1,2-benzothiazol-3-yl)piperazin-1-yl]-(4-fluorophenyl)methanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [4-(1,1-Dioxo-1,2-benzothiazol-3-yl)piperazin-1-yl]-(4-fluorophenyl)methanone?
Yes, KEHONG BIO provides custom synthesis services for [4-(1,1-Dioxo-1,2-benzothiazol-3-yl)piperazin-1-yl]-(4-fluorophenyl)methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.