2-(1,3-benzothiazol-2-ylsulfanyl)-N'-(2-fluorobenzylidene)acetohydrazide
TL;DR: 2-(1,3-benzothiazol-2-ylsulfanyl)-N'-(2-fluorobenzylidene)acetohydrazide (CAS 322413-49-0) is a chemical compound with molecular formula C16H12FN3OS2 and molecular weight 345.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1,3-benzothiazol-2-ylsulfanyl)-N-[(E)-(2-fluorophenyl)methylideneamino]acetamide
Also Known As: 2-(1,3-benzothiazol-2-ylsulfanyl)-N'-(2-fluorobenzylidene)acetohydrazide, 2-(1,3-benzothiazol-2-ylsulfanyl)-N'-[(E)-(2-fluorophenyl)methylidene]acetohydrazide, AI-020/34790056, 2-(1,3-benzothiazol-2-ylsulfanyl)-N-[(E)-(2-fluorophenyl)methylideneamino]acetamide, (E)-2-(benzo[d]thiazol-2-ylthio)-N'-(2-fluorobenzylidene)acetohydrazide
| Molecular Formula | C16H12FN3OS2 |
|---|---|
| Molecular Weight | 345.04 g/mol |
| LogP | 3.6778 |
| Topological Polar Surface Area | 54.35 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 345.0406 |
| Heavy Atoms | 23 |
| Complexity | 830.1625 |
Chemical Identifiers
| CAS Number | 322413-49-0 |
|---|---|
| SMILES | C1=CC=C(C(=C1)/C=N/NC(=O)CSC2=NC3=CC=CC=C3S2)F |
Product Overview
2-(1,3-benzothiazol-2-ylsulfanyl)-N'-(2-fluorobenzylidene)acetohydrazide (CAS 322413-49-0), with molecular formula C16H12FN3OS2 and molecular weight 345.04 g/mol. IUPAC: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-[(E)-(2-fluorophenyl)methylideneamino]acetamide.
Chemical Property Profile of 2-(1,3-benzothiazol-2-ylsulfanyl)-N'-(2-fluorobenzylidene)acetohydrazide
Property Insights of 2-(1,3-benzothiazol-2-ylsulfanyl)-N'-(2-fluorobenzylidene)acetohydrazide
The XLogP value of 3.6778 indicates that 2-(1,3-benzothiazol-2-ylsulfanyl)-N'-(2-fluorobenzylidene)acetohydrazide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.35 Ų, 2-(1,3-benzothiazol-2-ylsulfanyl)-N'-(2-fluorobenzylidene)acetohydrazide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(1,3-benzothiazol-2-ylsulfanyl)-N'-(2-fluorobenzylidene)acetohydrazide has 1 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 2-(1,3-benzothiazol-2-ylsulfanyl)-N'-(2-fluorobenzylidene)acetohydrazide?
The CAS number of 2-(1,3-benzothiazol-2-ylsulfanyl)-N'-(2-fluorobenzylidene)acetohydrazide is 322413-49-0.
What is the molecular formula of 2-(1,3-benzothiazol-2-ylsulfanyl)-N'-(2-fluorobenzylidene)acetohydrazide?
The molecular formula of 2-(1,3-benzothiazol-2-ylsulfanyl)-N'-(2-fluorobenzylidene)acetohydrazide is C16H12FN3OS2.
What is the molecular weight of 2-(1,3-benzothiazol-2-ylsulfanyl)-N'-(2-fluorobenzylidene)acetohydrazide?
The molecular weight of 2-(1,3-benzothiazol-2-ylsulfanyl)-N'-(2-fluorobenzylidene)acetohydrazide is 345.04 g/mol.
Where can I buy 2-(1,3-benzothiazol-2-ylsulfanyl)-N'-(2-fluorobenzylidene)acetohydrazide?
You can request a quote for 2-(1,3-benzothiazol-2-ylsulfanyl)-N'-(2-fluorobenzylidene)acetohydrazide 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)-N'-(2-fluorobenzylidene)acetohydrazide?
Yes, KEHONG BIO provides custom synthesis services for 2-(1,3-benzothiazol-2-ylsulfanyl)-N'-(2-fluorobenzylidene)acetohydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.