Oprea1_096011
N-[5-[2-(4-fluoroanilino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-2-naphthalen-1-ylacetamide
Also Known As: Oprea1_096011|F0417-0900|N-(4-fluorophenyl)-2-((5-(2-(naphthalen-1-yl)acetamido)-1,3,4-thiadiazol-2-yl)thio)acetamide|N-(4-fluorophenyl)-2-({5-[2-(naphthalen-1-yl)acetamido]-1,3,4-thiadiazol-2-yl}sulfanyl)acetamide|N-[5-[2-(4-fluoroanilino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-2-naphthalen-1-ylacetamide|N-[5-[(4-fluorophenyl)carbamoylmethylsulfanyl]-1,3,4-thiadiazol-2-yl]-2-naphthalen-1-yl-acetamide
| Molecular Formula | C22H17FN4O2S2 |
|---|---|
| Molecular Weight | 452.0777 g/mol |
| LogP | 4.7424 |
| Topological Polar Surface Area | 83.98 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 452.0777 |
| Monoisotopic Mass | 452.0777 |
| Heavy Atoms | 31 |
| Complexity | 1222.4081 |
Chemical Identifiers
| CAS Number | 392297-91-5 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=CC=C2CC(=O)NC3=NN=C(S3)SCC(=O)NC4=CC=C(C=C4)F |
Product Overview
Oprea1_096011 (CAS 392297-91-5), with molecular formula C22H17FN4O2S2 and molecular weight 452.0777 g/mol. IUPAC: N-[5-[2-(4-fluoroanilino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-2-naphthalen-1-ylacetamide.
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