N-[5-(ethoxymethyl)-1,3,4-thiadiazol-2-yl]-3-fluorobenzamide
TL;DR: N-[5-(ethoxymethyl)-1,3,4-thiadiazol-2-yl]-3-fluorobenzamide (CAS 768291-04-9) is a chemical compound with molecular formula C12H12FN3O2S and molecular weight 281.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[5-(ethoxymethyl)-1,3,4-thiadiazol-2-yl]-3-fluorobenzamide
Also Known As: BAS 09534454, N-[5-(ethoxymethyl)-1,3,4-thiadiazol-2-yl]-3-fluorobenzamide, N-(5-Ethoxymethyl-[1,3,4]thiadiazol-2-yl)-3-fluoro-benzamide, N-[5-(ethoxymethyl)(1,3,4-thiadiazol-2-yl)](3-fluorophenyl)carboxamide
| Molecular Formula | C12H12FN3O2S |
|---|---|
| Molecular Weight | 281.06 g/mol |
| LogP | 2.466 |
| Topological Polar Surface Area | 64.11 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 281.06342 |
| Heavy Atoms | 19 |
| Complexity | 573.60706 |
Chemical Identifiers
| CAS Number | 768291-04-9 |
|---|---|
| SMILES | CCOCC1=NN=C(S1)NC(=O)C2=CC(=CC=C2)F |
Product Overview
N-[5-(ethoxymethyl)-1,3,4-thiadiazol-2-yl]-3-fluorobenzamide (CAS 768291-04-9), with molecular formula C12H12FN3O2S and molecular weight 281.06 g/mol. IUPAC: N-[5-(ethoxymethyl)-1,3,4-thiadiazol-2-yl]-3-fluorobenzamide.
Chemical Property Profile of N-[5-(ethoxymethyl)-1,3,4-thiadiazol-2-yl]-3-fluorobenzamide
Property Insights of N-[5-(ethoxymethyl)-1,3,4-thiadiazol-2-yl]-3-fluorobenzamide
The XLogP value of 2.466 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[5-(ethoxymethyl)-1,3,4-thiadiazol-2-yl]-3-fluorobenzamide. The TPSA of 64.11 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[5-(ethoxymethyl)-1,3,4-thiadiazol-2-yl]-3-fluorobenzamide. Following Lipinski's Rule of Five, N-[5-(ethoxymethyl)-1,3,4-thiadiazol-2-yl]-3-fluorobenzamide 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-(ethoxymethyl)-1,3,4-thiadiazol-2-yl]-3-fluorobenzamide?
The CAS number of N-[5-(ethoxymethyl)-1,3,4-thiadiazol-2-yl]-3-fluorobenzamide is 768291-04-9.
What is the molecular formula of N-[5-(ethoxymethyl)-1,3,4-thiadiazol-2-yl]-3-fluorobenzamide?
The molecular formula of N-[5-(ethoxymethyl)-1,3,4-thiadiazol-2-yl]-3-fluorobenzamide is C12H12FN3O2S.
What is the molecular weight of N-[5-(ethoxymethyl)-1,3,4-thiadiazol-2-yl]-3-fluorobenzamide?
The molecular weight of N-[5-(ethoxymethyl)-1,3,4-thiadiazol-2-yl]-3-fluorobenzamide is 281.06 g/mol.
Where can I buy N-[5-(ethoxymethyl)-1,3,4-thiadiazol-2-yl]-3-fluorobenzamide?
You can request a quote for N-[5-(ethoxymethyl)-1,3,4-thiadiazol-2-yl]-3-fluorobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[5-(ethoxymethyl)-1,3,4-thiadiazol-2-yl]-3-fluorobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-[5-(ethoxymethyl)-1,3,4-thiadiazol-2-yl]-3-fluorobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.