![3,5-dichloro-N-[5-[(4-fluorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-4-methoxybenzamide structure](/static/products/827/827003-52-1.png)
3,5-dichloro-N-[5-[(4-fluorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-4-methoxybenzamide
TL;DR: 3,5-dichloro-N-[5-[(4-fluorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-4-methoxybenzamide (CAS 827003-52-1) is a chemical compound with molecular formula C17H12Cl2FN3O2S2 and molecular weight 442.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,5-dichloro-N-[5-[(4-fluorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-4-methoxybenzamide
Also Known As: 3,5-dichloro-N-[5-[(4-fluorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-4-methoxybenzamide, 3,5-dichloro-N-{5-[(4-fluorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-4-methoxybenzamide, 3,5-dichloro-N-[5-[(4-fluorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-4-methoxy-benzamide
| Molecular Formula | C17H12Cl2FN3O2S2 |
|---|---|
| Molecular Weight | 442.97 g/mol |
| LogP | 5.5372 |
| Topological Polar Surface Area | 64.11 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 442.9732 |
| Heavy Atoms | 27 |
| Complexity | 944.06244 |
Chemical Identifiers
| CAS Number | 827003-52-1 |
|---|---|
| SMILES | COC1=C(C=C(C=C1Cl)C(=O)NC2=NN=C(S2)SCC3=CC=C(C=C3)F)Cl |
Product Overview
3,5-dichloro-N-[5-[(4-fluorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-4-methoxybenzamide (CAS 827003-52-1), with molecular formula C17H12Cl2FN3O2S2 and molecular weight 442.97 g/mol. IUPAC: 3,5-dichloro-N-[5-[(4-fluorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-4-methoxybenzamide.
Chemical Property Profile of 3,5-dichloro-N-[5-[(4-fluorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-4-methoxybenzamide
Property Insights of 3,5-dichloro-N-[5-[(4-fluorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-4-methoxybenzamide
The XLogP value of 5.5372 indicates that 3,5-dichloro-N-[5-[(4-fluorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-4-methoxybenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.11 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,5-dichloro-N-[5-[(4-fluorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-4-methoxybenzamide. Following Lipinski's Rule of Five, 3,5-dichloro-N-[5-[(4-fluorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-4-methoxybenzamide has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3,5-dichloro-N-[5-[(4-fluorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-4-methoxybenzamide?
The CAS number of 3,5-dichloro-N-[5-[(4-fluorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-4-methoxybenzamide is 827003-52-1.
What is the molecular formula of 3,5-dichloro-N-[5-[(4-fluorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-4-methoxybenzamide?
The molecular formula of 3,5-dichloro-N-[5-[(4-fluorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-4-methoxybenzamide is C17H12Cl2FN3O2S2.
What is the molecular weight of 3,5-dichloro-N-[5-[(4-fluorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-4-methoxybenzamide?
The molecular weight of 3,5-dichloro-N-[5-[(4-fluorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-4-methoxybenzamide is 442.97 g/mol.
Where can I buy 3,5-dichloro-N-[5-[(4-fluorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-4-methoxybenzamide?
You can request a quote for 3,5-dichloro-N-[5-[(4-fluorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-4-methoxybenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,5-dichloro-N-[5-[(4-fluorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-4-methoxybenzamide?
Yes, KEHONG BIO provides custom synthesis services for 3,5-dichloro-N-[5-[(4-fluorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-4-methoxybenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.