N-(5-((2-fluorobenzyl)thio)-1,3,4-thiadiazol-2-yl)cinnamamide
TL;DR: N-(5-((2-fluorobenzyl)thio)-1,3,4-thiadiazol-2-yl)cinnamamide (CAS 532980-75-9) is a chemical compound with molecular formula C18H14FN3OS2 and molecular weight 371.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-N-[5-[(2-fluorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-3-phenylprop-2-enamide
Also Known As: N-(5-((2-fluorobenzyl)thio)-1,3,4-thiadiazol-2-yl)cinnamamide, (2E)-N-{5-[(2-fluorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-3-phenylprop-2-enamide, (E)-N-[5-[(2-fluorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-3-phenylprop-2-enamide
| Molecular Formula | C18H14FN3OS2 |
|---|---|
| Molecular Weight | 371.06 g/mol |
| LogP | 4.6214 |
| Topological Polar Surface Area | 54.88 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 371.05624 |
| Heavy Atoms | 25 |
| Complexity | 880.7924 |
Chemical Identifiers
| CAS Number | 532980-75-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)/C=C/C(=O)NC2=NN=C(S2)SCC3=CC=CC=C3F |
Product Overview
N-(5-((2-fluorobenzyl)thio)-1,3,4-thiadiazol-2-yl)cinnamamide (CAS 532980-75-9), with molecular formula C18H14FN3OS2 and molecular weight 371.06 g/mol. IUPAC: (E)-N-[5-[(2-fluorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-3-phenylprop-2-enamide.
Chemical Property Profile of N-(5-((2-fluorobenzyl)thio)-1,3,4-thiadiazol-2-yl)cinnamamide
Property Insights of N-(5-((2-fluorobenzyl)thio)-1,3,4-thiadiazol-2-yl)cinnamamide
The XLogP value of 4.6214 indicates that N-(5-((2-fluorobenzyl)thio)-1,3,4-thiadiazol-2-yl)cinnamamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.88 Ų, N-(5-((2-fluorobenzyl)thio)-1,3,4-thiadiazol-2-yl)cinnamamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(5-((2-fluorobenzyl)thio)-1,3,4-thiadiazol-2-yl)cinnamamide 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 N-(5-((2-fluorobenzyl)thio)-1,3,4-thiadiazol-2-yl)cinnamamide?
The CAS number of N-(5-((2-fluorobenzyl)thio)-1,3,4-thiadiazol-2-yl)cinnamamide is 532980-75-9.
What is the molecular formula of N-(5-((2-fluorobenzyl)thio)-1,3,4-thiadiazol-2-yl)cinnamamide?
The molecular formula of N-(5-((2-fluorobenzyl)thio)-1,3,4-thiadiazol-2-yl)cinnamamide is C18H14FN3OS2.
What is the molecular weight of N-(5-((2-fluorobenzyl)thio)-1,3,4-thiadiazol-2-yl)cinnamamide?
The molecular weight of N-(5-((2-fluorobenzyl)thio)-1,3,4-thiadiazol-2-yl)cinnamamide is 371.06 g/mol.
Where can I buy N-(5-((2-fluorobenzyl)thio)-1,3,4-thiadiazol-2-yl)cinnamamide?
You can request a quote for N-(5-((2-fluorobenzyl)thio)-1,3,4-thiadiazol-2-yl)cinnamamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(5-((2-fluorobenzyl)thio)-1,3,4-thiadiazol-2-yl)cinnamamide?
Yes, KEHONG BIO provides custom synthesis services for N-(5-((2-fluorobenzyl)thio)-1,3,4-thiadiazol-2-yl)cinnamamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.