2-(1,3-Benzothiazol-2-ylsulfanyl)-1-(4-fluorophenyl)ethanone
TL;DR: 2-(1,3-Benzothiazol-2-ylsulfanyl)-1-(4-fluorophenyl)ethanone (CAS 296273-44-4) is a chemical compound with molecular formula C15H10FNOS2 and molecular weight 303.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1,3-benzothiazol-2-ylsulfanyl)-1-(4-fluorophenyl)ethanone
Also Known As: 2-(1,3-benzothiazol-2-ylsulfanyl)-1-(4-fluorophenyl)ethanone, J3.583.711F, alpha-(2-Benzothiazolylthio)-4 -fluoroacetophenone, 2-benzothiazol-2-ylthio-1-(4-fluorophenyl)ethan-1-one, 2-(1,3-benzothiazol-2-ylsulfanyl)-1-(4-fluorophenyl)ethan-1-one
| Molecular Formula | C15H10FNOS2 |
|---|---|
| Molecular Weight | 303.02 g/mol |
| LogP | 4.4104 |
| Topological Polar Surface Area | 29.96 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 303.0188 |
| Heavy Atoms | 20 |
| Complexity | 718.9143 |
Chemical Identifiers
| CAS Number | 296273-44-4 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N=C(S2)SCC(=O)C3=CC=C(C=C3)F |
Product Overview
2-(1,3-Benzothiazol-2-ylsulfanyl)-1-(4-fluorophenyl)ethanone (CAS 296273-44-4), with molecular formula C15H10FNOS2 and molecular weight 303.02 g/mol. IUPAC: 2-(1,3-benzothiazol-2-ylsulfanyl)-1-(4-fluorophenyl)ethanone.
Chemical Property Profile of 2-(1,3-Benzothiazol-2-ylsulfanyl)-1-(4-fluorophenyl)ethanone
Property Insights of 2-(1,3-Benzothiazol-2-ylsulfanyl)-1-(4-fluorophenyl)ethanone
The XLogP value of 4.4104 indicates that 2-(1,3-Benzothiazol-2-ylsulfanyl)-1-(4-fluorophenyl)ethanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.96 Ų, 2-(1,3-Benzothiazol-2-ylsulfanyl)-1-(4-fluorophenyl)ethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(1,3-Benzothiazol-2-ylsulfanyl)-1-(4-fluorophenyl)ethanone 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 2-(1,3-Benzothiazol-2-ylsulfanyl)-1-(4-fluorophenyl)ethanone?
The CAS number of 2-(1,3-Benzothiazol-2-ylsulfanyl)-1-(4-fluorophenyl)ethanone is 296273-44-4.
What is the molecular formula of 2-(1,3-Benzothiazol-2-ylsulfanyl)-1-(4-fluorophenyl)ethanone?
The molecular formula of 2-(1,3-Benzothiazol-2-ylsulfanyl)-1-(4-fluorophenyl)ethanone is C15H10FNOS2.
What is the molecular weight of 2-(1,3-Benzothiazol-2-ylsulfanyl)-1-(4-fluorophenyl)ethanone?
The molecular weight of 2-(1,3-Benzothiazol-2-ylsulfanyl)-1-(4-fluorophenyl)ethanone is 303.02 g/mol.
Where can I buy 2-(1,3-Benzothiazol-2-ylsulfanyl)-1-(4-fluorophenyl)ethanone?
You can request a quote for 2-(1,3-Benzothiazol-2-ylsulfanyl)-1-(4-fluorophenyl)ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(1,3-Benzothiazol-2-ylsulfanyl)-1-(4-fluorophenyl)ethanone?
Yes, KEHONG BIO provides custom synthesis services for 2-(1,3-Benzothiazol-2-ylsulfanyl)-1-(4-fluorophenyl)ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.